SCHEMBL3397327

SCHEMBL3397327

Bc1ccc2nnc(Sc3ccc4nc(NC(=O)C5CC5)cn4n3)n2c1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.44
CSNK1D P48730 9/20 0.42
CSNK1E P49674 9/20 0.42
MET P08581 2/20 0.39
BRAF P15056 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
SCHEMBL5954869 0.90 KDR (0.48) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL251983 0.89 KDR (0.43) KDRCSNK1DCSNK1EMET
SCHEMBL250805 0.89 KDR (0.43) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL5955351 0.89 KDR (0.43) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL252254 0.89 KDR (0.43) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL6006706 0.89 KDR (0.44) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL252980 0.88 KDR (0.43) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL5954382 0.87 KDR (0.42) KDRCSNK1DCSNK1EMETBRAF
SCHEMBL5955024 0.87 KDR (0.44) KDRCSNK1DCSNK1EMET
SCHEMBL5954136 0.87 KDR (0.42) KDRCSNK1DCSNK1EMETBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed