SCHEMBL29487138

SCHEMBL29487138

COc1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2cc1Br

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.50
PDGFRA P16234 4/20 0.50
MET P08581 10/20 0.47
IGF1R P08069 1/20 0.47
FGFR2 P21802 1/20 0.47
AXL P30530 3/20 0.44
MERTK Q12866 1/20 0.44
PDGFRB P09619 1/20 0.44
AMY1A P0DUB6 1/20 0.43

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
SCHEMBL22960033 1.00 KDR (0.50) KDRPDGFRAMETIGF1RFGFR2
SCHEMBL29487188 0.91 PDGFRA (0.59) KDRPDGFRAMETFGFR2AXL
SCHEMBL174159 0.91 PDGFRA (0.59) KDRPDGFRAMETFGFR2AXL
SCHEMBL31393028 0.88 PDGFRA (0.48) KDRPDGFRAMETIGF1RFGFR2
SCHEMBL13936618 0.87 PDGFRA (0.52) KDRPDGFRAMETFGFR2AXL
SCHEMBL14966986 0.87 PDGFRA (0.59) KDRPDGFRAPDGFRBAMY1A
SCHEMBL1133098 0.87 AXL (0.59) KDRPDGFRAMETAXLMERTK
SCHEMBL1133096 0.87 AXL (0.59) KDRPDGFRAMETAXLMERTK
SCHEMBL20032552 0.86 PDGFRA (0.51) KDRPDGFRAMETIGF1RFGFR2
SCHEMBL22009936 0.85 PDGFRA (0.56) KDRPDGFRAMETFGFR2AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114206883-A Oxopyridine fused ring derivative and pharmaceutical composition comprising the same 伟迈可生物有限公司 2022-03-18 CN disclosed