SCHEMBL3333435

SCHEMBL3333435

NC(=O)c1ncn2c(=O)n(Cc3ccccc3)nnc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
PABPC1 P11940 1/20 0.56
HPGD P15428 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.43
CYP1A2 P05177 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 2/20 0.43
PKM P14618 2/20 0.43
GAA P10253 2/20 0.43
IDO1 P14902 1/20 0.42
SLC12A2 P55011 1/20 0.40
SLC12A5 Q9H2X9 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
HCAR3 P49019 1/20 0.39

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
SCHEMBL2886687 0.88 KMT2A (0.57) MEN1KMT2APABPC1HPGDSMN1; SMN2
SCHEMBL4011814 0.85 MEN1 (0.54) MEN1KMT2APABPC1HPGDL3MBTL1
SCHEMBL13027973 0.85 MEN1 (0.51) MEN1KMT2APABPC1HPGDSMN1; SMN2
SCHEMBL2885903 0.84 MEN1 (0.50) MEN1KMT2APABPC1HPGDPKM
SCHEMBL2889516 0.83 MEN1 (0.52) MEN1KMT2APABPC1HPGDSMN1; SMN2
SCHEMBL13799945 0.83 MEN1 (0.55) MEN1KMT2APABPC1HPGDSMN1; SMN2
SCHEMBL25435017 0.83 KMT2A (0.54) MEN1KMT2APABPC1HPGDSMN1; SMN2
SCHEMBL13027994 0.83 MEN1 (0.63) MEN1KMT2APABPC1SMN1; SMN2CA12
SCHEMBL2889998 0.83 MEN1 (0.63) MEN1KMT2APABPC1HPGDMAPK1
SCHEMBL13027731 0.83 MEN1 (0.71) MEN1KMT2APABPC1CA12CA1

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100143340-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER SCHERING CORPORATION 2010-06-10 US claimed
EP-2121018-A2 TREATING CANCER WITH ANTI-IGF1R ANTIBODY 19D12=SCH 717454 SCHERING CORPORATION (US) 2009-11-25 EP claimed
WO-2008076257-A2 TREATING CANCER WITH ANTI-IGFLR ANTIBODY 19D12 = SCH 717454 SCHERING CORPORATION (US) 2008-06-26 WO claimed
US-5260291-A Tetrazine derivatives CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1993-11-09 US claimed
EP-3116507-B1 COMPOUNDS FOR ORAL TREATMENT OF BRAIN TUMORS KADMON CORP LLC (US) 2021-05-26 EP disclosed
US-10080752-B2 Treatment of brain and central nervous system tumors KADMON CORPORATION, LLC (US) 2018-09-25 US disclosed
US-20170071943-A1 TREATMENT OF BRAIN AND CENTRAL NERVOUS SYSTEM TUMORS KADMON CORPORATION, LLC 2017-03-16 US disclosed
EP-3116507-A1 TREATMENT OF BRAIN AND CENTRAL NERVOUS SYSTEM TUMORS Kadmon Corporation, LLC (US) 2017-01-18 EP disclosed
WO-2015138420-A1 TREATMENT OF BRAIN AND CENTRAL NERVOUS SYSTEM TUMORS KADMON CORPORATION, LLC (US) 2015-09-17 WO disclosed
US-8450479-B2 3-substituted-4-oxo-3,4-dihydro-imidazo[5,1-d][1,2,3,5-tetrazine-8-carboxylic acid amides and their use PHARMINOX LIMITED (GB) 2013-05-28 US disclosed
US-8450479-B2 3-substituted-4-oxo-3,4-dihydro-imidazo[5,1-d][1,2,3,5-tetrazine-8-carboxylic acid amides and their use PHARMINOX LIMITED (GB) 2013-05-28 US disclosed
US-20130012706-A1 Methods and Intermediates for the Synthesis of 4-oxo-3,4-dihydro-imidazo[5,1-d][1,2,3,5]tetrazines PHARMINOX LIMITED (GB) 2013-01-10 US disclosed
WO-2009077741-A2 3-SUBSTITUTED-4-OXO-3,4-DIHYDRO-IMIDAZO-[5,1-D][1,2,3,5-TETRAZINE-8-CARBOXYLIC ACID AMIDES AND THEIR USE PHARMINOX LIMITED (GB) 2009-06-25 WO disclosed
WO-2008076257-A2 TREATING CANCER WITH ANTI-IGFLR ANTIBODY 19D12 = SCH 717454 SCHERING CORPORATION (US) 2008-06-26 WO disclosed
EP-1896505-A2 ANTI-IGF1R ANTIBODY FORMULATIONS SCHERING CORPORATION (US) 2008-03-12 EP disclosed
WO-2006138315-A2 ANTI-IGF1R ANTIBODY FORMULATIONS SCHERING CORPORATION (US) 2006-12-28 WO disclosed
US-20060286103-A1 Stable antibody formulation MERCK SHARP & DOHME CORP. 2006-12-21 US disclosed
US-20060205810-A1 Platinum therapeutic combinations SCHERING CORPORATION 2006-09-14 US disclosed
WO-2006057998-A1 BINARY ANTITUMOR COMPOSITIONS PLATINUM (IV) DERIVATIVES SCHERING CORPORATION (US) 2006-06-01 WO disclosed
US-5260291-A Tetrazine derivatives CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1993-11-09 US 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 (6 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-20170071943-A1 TREATMENT OF BRAIN AND CENTRAL NERVOUS SYSTEM TUMORS ERBB2, EGFR, ERBB3 MEN1 2161/4885KMT2A 315/4885PABPC1 4868/4885
US-10080752-B2 Treatment of brain and central nervous system tumors ERBB2, EGFR, ERBB3 MEN1 2161/4885KMT2A 315/4885PABPC1 4868/4885
US-20130012706-A1 Methods and Intermediates for the Synthesis of 4-oxo-3,4-dihydro-imidazo[5,1-d][1,2,3,5]tetrazines H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CA6, TALDO1 MEN1 216/4885KMT2A 327/4885PABPC1 4575/4885
US-20100143340-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER TP53, KLK3, CD44 MEN1 766/4885KMT2A 2490/4885PABPC1 916/4885
US-20060205810-A1 Platinum therapeutic combinations MGMT, PARP2, TYMP MEN1 402/4885KMT2A 1057/4885PABPC1 736/4885
US-20060286103-A1 Stable antibody formulation FCGR3B, FCGR2A, FCGR1A MEN1 1331/4885KMT2A 2046/4885PABPC1 1301/4885

“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.