SCHEMBL253785

SCHEMBL253785

Cn1cc(-c2ccc3nnn(Cc4ccc5nc(NC(=O)C6CC6)cn5n4)c3c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 14/20 0.47
DYRK1A Q13627 14/20 0.47
WNT1 P04628 11/20 0.47
ABL1 P00519 1/20 0.47
CSNK1D P48730 3/20 0.45
CSNK1E P49674 3/20 0.45
KDR P35968 1/20 0.43
TEK Q02763 1/20 0.43
PIK3CG P48736 1/20 0.42

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
SCHEMBL2747669 0.91 CSNK1D (0.39) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL5955411 0.89 GSK3B (0.41) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL10274940 0.89 PIK3CA (0.40) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL2746330 0.88 CSNK1D (0.45) CSNK1DCSNK1EKDR
SCHEMBL5955085 0.88 CCNC (0.39) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL5955181 0.87 KDR (0.39) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL1551274 0.86 KDR (0.45) ABL1CSNK1DCSNK1EKDR
SCHEMBL2746459 0.86 CDK9 (0.36) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL2745972 0.86 CDK9 (0.36) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL2745977 0.86 CDK9 (0.36) GSK3BDYRK1AWNT1ABL1CSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313407-B1 cMET INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2016-10-05 EP disclosed
EP-2313407-B1 cMET INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2016-10-05 EP disclosed
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
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
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
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 GSK3B 576/4885DYRK1A 2985/4885WNT1 632/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT GSK3B 35/4885DYRK1A 4332/4885WNT1 2494/4885

“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.