SCHEMBL2899729

SCHEMBL2899729

Cc1sc2c(c1C)C(c1ccc(Nc3ccccc3)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.85
BRD2 P25440 4/20 0.66
ADORA3 P0DMS8 1/20 0.65
TSPO P30536 1/20 0.65
DNER Q8NFT8 1/20 0.65
BRD3 Q15059 1/20 0.64

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3197604 0.94 BRD4 (0.77) BRD4BRD2ADORA3TSPODNER
SCHEMBL3211139 0.93 BRD4 (0.75) BRD4BRD2ADORA3TSPODNER
SCHEMBL3198871 0.93 BRD4 (0.74) BRD4BRD2ADORA3TSPODNER
SCHEMBL3198838 0.93 BRD4 (0.83) BRD4BRD2ADORA3TSPODNER
SCHEMBL3200319 0.92 BRD4 (0.73) BRD4BRD2ADORA3TSPODNER
SCHEMBL13028879 0.92 BRD4 (1.00) BRD4BRD2ADORA3TSPODNER
SCHEMBL3210275 0.92 BRD4 (0.75) BRD4BRD2ADORA3TSPODNER
SCHEMBL3189634 0.92 BRD4 (0.73) BRD4BRD2ADORA3TSPODNER
SCHEMBL3189663 0.92 BRD4 (0.72) BRD4BRD2ADORA3TSPODNER
SCHEMBL25092048 0.92 BRD4 (0.83) BRD4BRD2ADORA3TSPODNER

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 59 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1887008-B1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2021-04-21 EP claimed
EP-2863923-B1 THIENOTRIAZOLODIAZEPINE COMPOUNDS FOR THE TREATMENT OF LYMPHOMAS ONCOETHIX GMBH (CH) 2019-05-08 EP claimed
US-20170157141-A1 METHOD OF TREATING LEUKEMIA USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-06-08 US claimed
EP-3154549-A1 METHOD OF TREATING NON-SMALL CELL LUNG CANCER AND/OR SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix GmbH (CH) 2017-04-19 EP claimed
EP-3137086-A1 METHOD OF TREATING RESISTANT NON-HODGKIN LYMPHOMA, MEDULLOBLASTOMA, AND/OR ALK+NON-SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix GmbH (CH) 2017-03-08 EP claimed
US-20160375032-A1 METHOD OF TREATING NON-SMALL-CELL LUNG CANCER USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2016-12-29 US claimed
US-20160158245-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2016-06-09 US claimed
US-20160158246-A1 METHOD OF TREATING DIFFUSE LARGE B-CELL LYMPHOMA (DLBCL) USING A BET-BROMODOMAIN INHIBITOR ONCOETHIX GMBH (CH) 2016-06-09 US claimed
WO-2015189814-A1 METHOD OF TREATING NON-SMALL CELL LUNG CANCER AND/OR SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2015-12-17 WO claimed
WO-2015168555-A1 METHOD OF TREATING RESISTANT NON-HODGKIN LYMPHOMA, MEDULLOBLASTOMA, AND/OR ALK+NON-SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2015-11-05 WO claimed
US-9125915-B2 Antitumor agent MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-09-08 US claimed
WO-2015078931-A1 METHOD OF TREATING NEUROBLASTOMAS USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2015-06-04 WO claimed
WO-2015018523-A1 A NOVEL BET-BRD INHIBITOR FOR TREATMENT OF SOLID TUMORS ONCOETHIX SA (CH) 2015-02-12 WO claimed
US-20140107107-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2014-04-17 US claimed
US-8476260-B2 Antitumor agent MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-07-02 US claimed
US-20100286127-A1 ANTITUMOR AGENT MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-11-11 US claimed
EP-2239264-A1 ANTITUMOR AGENT Mitsubishi Tanabe Pharma Corporation (JP) 2010-10-13 EP claimed
US-20100041643-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-02-18 US claimed
EP-1887008-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2008-02-13 EP claimed
WO-2022132049-A1 TREATING CANCERS USING BET INHIBITORS NATIONAL UNIVERSITY OF SINGAPORE (SG) 2022-06-23 WO disclosed
EP-1887008-B1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2021-04-21 EP disclosed
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2020-10-27 US disclosed
EP-2863923-B1 THIENOTRIAZOLODIAZEPINE COMPOUNDS FOR THE TREATMENT OF LYMPHOMAS ONCOETHIX GMBH (CH) 2019-05-08 EP disclosed
US-9968620-B2 Methods of treating lymphoma using thienotriazolodiazepine compounds ONCOETHIX GMBH (CH) 2018-05-15 US disclosed
US-9968619-B2 Method of treating triple-negative breast cancer using thienotriazolodiazepine compounds ONCOETHIX GMBH (CH) 2018-05-15 US disclosed
US-9956228-B2 Method of treating acute myeloid leukemia and/or acute lymphoblastic leukemia using thienotriazolodiazepine compounds ONCOETHIX GMBH (CH) 2018-05-01 US disclosed
US-9901583-B2 Method of treating non-small cell lung cancer and/or small cell lung cancer using thienotriazolodiazepine compounds ONCOETHIX GMBH (CH) 2018-02-27 US disclosed
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-12-21 US disclosed
US-9820992-B2 Method of treating non-small-cell lung cancer using pharmaceutical formulation containing thienotriazolodiazepine compounds MERCK SHARP & DOHME CORP. (US) 2017-11-21 US disclosed
US-9795612-B2 Pharmaceutical formulation containing thienotriazolodiazepine compounds MERCK SHARP & DOHME CORP. (US) 2017-10-24 US disclosed
EP-3226898-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. Lee Moffitt Cancer Center And Research Institute, Inc. (US) 2017-10-11 EP disclosed
US-20170273988-A1 METHODS OF TREATING LYMPHOMA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-09-28 US disclosed
US-9757385-B2 Method of treating leukemia using pharmaceutical formulation containing thienotriazolodiazepine compounds MERCK SHARP & DOHME CORP. (US) 2017-09-12 US disclosed
US-20170157141-A1 METHOD OF TREATING LEUKEMIA USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-06-08 US disclosed
US-20170151255-A1 METHOD OF TREATING NON-SMALL CELL LUNG CANCER AND/OR SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-06-01 US disclosed
US-20170095484-A1 METHOD OF TREATING RESISTANT NON-HODGKIN LYMPHOMA, MEDULLOBLASTOMA, AND/OR ALK+NON-SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-04-06 US disclosed
EP-3139959-A1 METHOD OF TREATING TRIPLE-NEGATIVE BREAST CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix GmbH (CH) 2017-03-15 EP disclosed
US-20170065607-A1 METHOD OF TREATING TRIPLE-NEGATIVE BREAST CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-03-09 US disclosed
EP-3137085-A1 METHOD OF TREATING ACUTE MYELOID LEUKEMIA AND/OR ACUTE LYMPHOBLASTIC LEUKEMIA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix GmbH (CH) 2017-03-08 EP disclosed
US-20170049784-A1 METHOD OF TREATING ACUTE MYELOID LEUKEMIA AND/OR ACUTE LYMPHOBLASTIC LEUKEMIA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2017-02-23 US disclosed
US-20160375032-A1 METHOD OF TREATING NON-SMALL-CELL LUNG CANCER USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2016-12-29 US disclosed
US-20160158246-A1 METHOD OF TREATING DIFFUSE LARGE B-CELL LYMPHOMA (DLBCL) USING A BET-BROMODOMAIN INHIBITOR ONCOETHIX GMBH (CH) 2016-06-09 US disclosed
US-20160158245-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2016-06-09 US disclosed
WO-2016090219-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2016-06-09 WO disclosed
US-20150335656-A1 ANTITUMOR AGENT MITSUBISHI TANABE PHARMA CORP (JP) 2015-11-26 US disclosed
WO-2015169951-A1 METHOD OF TREATING TRIPLE-NEGATIVE BREAST CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2015-11-12 WO disclosed
WO-2015168621-A1 METHOD OF TREATING ACUTE MYELOID LEUKEMIA AND/OR ACUTE LYMPHOBLASTIC LEUKEMIA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2015-11-05 WO disclosed
US-9125915-B2 Antitumor agent MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-09-08 US disclosed
EP-2900221-A2 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix SA (CH) 2015-08-05 EP disclosed
EP-2863923-A1 METHOD OF TREATING LYMPHOMA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS Oncoethix SA (CH) 2015-04-29 EP disclosed
WO-2014068402-A2 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2014-05-08 WO disclosed
US-20140107107-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX GMBH (CH) 2014-04-17 US disclosed
WO-2014001356-A1 METHOD OF TREATING LYMPHOMA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ONCOETHIX SA (CH) 2014-01-03 WO disclosed
US-20130261109-A1 ANTITUMOR AGENT MITSUBISHI TANABE PHARMA CORP (JP) 2013-10-03 US disclosed
US-8476260-B2 Antitumor agent MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-07-02 US disclosed
US-20100286127-A1 ANTITUMOR AGENT MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-11-11 US disclosed
EP-2239264-A1 ANTITUMOR AGENT Mitsubishi Tanabe Pharma Corporation (JP) 2010-10-13 EP disclosed
US-20100041643-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-02-18 US disclosed
EP-1887008-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2008-02-13 EP disclosed
EP-1887008-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2008-02-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (16 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160158246-A1 METHOD OF TREATING DIFFUSE LARGE B-CELL LYMPHOMA (DLBCL) USING A BET-BROMODOMAIN INHIBITOR BRD4, BRD7, BCL6 BRD4 1/4885BRD2 10/4885ADORA3 2844/4885
US-20130261109-A1 ANTITUMOR AGENT BRPF3, BRDT, BRD4 BRD4 3/4885BRD2 5/4885ADORA3 3430/4885
US-20170049784-A1 METHOD OF TREATING ACUTE MYELOID LEUKEMIA AND/OR ACUTE LYMPHOBLASTIC LEUKEMIA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS MCL1, FLT3, HCLS1 BRD4 137/4885BRD2 206/4885ADORA3 343/4885
US-20170157141-A1 METHOD OF TREATING LEUKEMIA USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS CCR10, HRH4, H1-10 BRD4 22/4885BRD2 128/4885ADORA3 218/4885
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy BRDT, BRD4, BRD1 BRD4 2/4885BRD2 4/4885ADORA3 3692/4885
US-20140107107-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS HRH4, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HTR3D BRD4 97/4885BRD2 121/4885ADORA3 126/4885
US-20170151255-A1 METHOD OF TREATING NON-SMALL CELL LUNG CANCER AND/OR SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SLC19A2, TBXA2R BRD4 15/4885BRD2 53/4885ADORA3 746/4885
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY BRDT, BRD4, BRD1 BRD4 2/4885BRD2 4/4885ADORA3 3692/4885
US-20100286127-A1 ANTITUMOR AGENT BRDT, HDAC1, BRPF3 BRD4 4/4885BRD2 8/4885ADORA3 3996/4885
US-20160375032-A1 METHOD OF TREATING NON-SMALL-CELL LUNG CANCER USING PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HRH4, CCR10 BRD4 20/4885BRD2 137/4885ADORA3 468/4885
US-20170095484-A1 METHOD OF TREATING RESISTANT NON-HODGKIN LYMPHOMA, MEDULLOBLASTOMA, AND/OR ALK+NON-SMALL CELL LUNG CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS ALK, MALT1, BCL6 BRD4 356/4885BRD2 441/4885ADORA3 644/4885
US-20100041643-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND MEDICINAL USE THEREOF ICOS, CD4, CD2 BRD4 265/4885BRD2 318/4885ADORA3 76/4885
US-20170273988-A1 METHODS OF TREATING LYMPHOMA USING THIENOTRIAZOLODIAZEPINE COMPOUNDS BCL6, BCL6B, BCL9 BRD4 10/4885BRD2 45/4885ADORA3 1911/4885
US-20160158245-A1 PHARMACEUTICAL FORMULATION CONTAINING THIENOTRIAZOLODIAZEPINE COMPOUNDS ABL1, BCR, FLT3 BRD4 16/4885BRD2 62/4885ADORA3 434/4885
US-20150335656-A1 ANTITUMOR AGENT BRPF3, BRDT, BRD4 BRD4 3/4885BRD2 5/4885ADORA3 3430/4885
US-20170065607-A1 METHOD OF TREATING TRIPLE-NEGATIVE BREAST CANCER USING THIENOTRIAZOLODIAZEPINE COMPOUNDS CDK10, HRH4, H1-10 BRD4 15/4885BRD2 221/4885ADORA3 2496/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.