SCHEMBL2900749

SCHEMBL2900749

O=C([CH]O)Nc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.65
CYP1A2 P05177 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
MAOB P27338 4/20 0.59
MMP1 P03956 3/20 0.59
MMP2 P08253 3/20 0.59
MMP9 P14780 3/20 0.59
MAOA P21397 2/20 0.59
EGFR P00533 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58
TP53 P04637 1/20 0.58
EPHX1 P07099 1/20 0.58
TSHR P16473 1/20 0.58
EPHX2 P34913 1/20 0.58
CDK9 P50750 1/20 0.58
CLK4 Q9HAZ1 1/20 0.58
NAPRT Q6XQN6 1/20 0.54
HSD17B10 Q99714 1/20 0.54
MAPT P10636 2/20 0.50
KDM4E B2RXH2 2/20 0.50

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
SCHEMBL6302448 0.83 MMP1 (0.73) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL6302452 0.83 MMP1 (0.73) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL9840923 0.83 MMP1 (0.73) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL14154228 0.82 MMP1 (0.66) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL1772810 0.82 MMP1 (0.66) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL725250 0.81 TGM2 (0.65) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL2664164 0.79 TGM2 (0.63) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL5830369 0.79 TGM2 (0.63) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL9080645 0.79 TGM2 (0.63) TGM2CYP1A2NPSR1MAOBMMP1
SCHEMBL6581501 0.79 TGM2 (0.63) TGM2CYP1A2NPSR1MAOBMMP1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2022132049-A1 TREATING CANCERS USING BET INHIBITORS NATIONAL UNIVERSITY OF SINGAPORE (SG) 2022-06-23 WO 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
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2017-12-21 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
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
US-9125915-B2 Antitumor agent MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-09-08 US 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
CN-1097417-A New heterogeneous ring compound FUJISAWA PHARMACEUTICAL CO (JP) 1995-01-18 CN disclosed
CN-1089947-A New heterogeneous ring compound FUJISAWA PHARMACEUTICAL CO (JP) 1994-07-27 CN 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 (5 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-20130261109-A1 ANTITUMOR AGENT BRPF3, BRDT, BRD4 TGM2 2677/4885CYP1A2 4877/4885NPSR1 3480/4885
US-10813939-B2 Bromodomain inhibitor as adjuvant in cancer immunotherapy BRDT, BRD4, BRD1 TGM2 2036/4885CYP1A2 4596/4885NPSR1 3994/4885
US-20170360801-A1 BROMODOMAIN INHIBITOR AS ADJUVANT IN CANCER IMMUNOTHERAPY BRDT, BRD4, BRD1 TGM2 2036/4885CYP1A2 4596/4885NPSR1 3994/4885
US-20100286127-A1 ANTITUMOR AGENT BRDT, HDAC1, BRPF3 TGM2 2619/4885CYP1A2 4873/4885NPSR1 3987/4885
US-20150335656-A1 ANTITUMOR AGENT BRPF3, BRDT, BRD4 TGM2 2677/4885CYP1A2 4877/4885NPSR1 3480/4885

“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.