SCHEMBL253537

SCHEMBL253537

N#Cc1cccc(-c2ccc3nnc(Sc4ccc5nc(NC(=O)C6CC6)cn5n4)n3c2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.43
USP30 Q70CQ3 2/20 0.42
CSNK1D P48730 4/20 0.41
CSNK1E P49674 4/20 0.41
JAK1 P23458 3/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CG P48736 1/20 0.40
GSK3B P49841 1/20 0.40
KDM4E B2RXH2 1/20 0.38
BRAF P15056 1/20 0.38
RIPK1 Q13546 1/20 0.38

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
SCHEMBL252644 0.88 KDR (0.42) KDRCSNK1DCSNK1EJAK1KDM4E
SCHEMBL2747202 0.88 KDR (0.47) KDRCSNK1DCSNK1EBRAFRIPK1
SCHEMBL5954386 0.85 KDR (0.43) KDRCSNK1DCSNK1EJAK1PIK3CD
SCHEMBL253766 0.84 ABL1 (0.37) KDRCSNK1DCSNK1EJAK1GSK3B
SCHEMBL251980 0.83 KDR (0.41) KDRCSNK1DCSNK1EJAK1PIK3CD
SCHEMBL5955517 0.83 CSNK1D (0.43) KDRCSNK1DCSNK1EGSK3BRIPK1
SCHEMBL5954568 0.83 KDR (0.42) KDRCSNK1DCSNK1EJAK1BRAF
SCHEMBL5954829 0.83 CSNK1D (0.44) KDRCSNK1DCSNK1EJAK1RIPK1
SCHEMBL251969 0.83 KDR (0.39) KDRCSNK1DCSNK1EJAK1
SCHEMBL5954598 0.82 PIK3CA (0.45) KDRCSNK1DCSNK1EJAK1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-28 US disclosed
EP-2588107-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET Takeda Pharmaceutical Company Limited (JP) 2013-05-08 EP disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
EP-2313407-A1 cMET INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-04-27 EP disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO 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 (2 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-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET HGF, MET, HGFAC KDR 142/4885USP30 1855/4885CSNK1D 2737/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT KDR 1387/4885USP30 1439/4885CSNK1D 225/4885

“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.