SCHEMBL14693185

SCHEMBL14693185

CCNC(=O)Nc1ccc(Oc2ccnc3cc(OC)c(C(=O)NC4CC4)cc23)cc1CI

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.61
RET P07949 5/20 0.61
AURKB Q96GD4 4/20 0.61
PDGFRA P16234 4/20 0.61
KIT P10721 3/20 0.61
FGFR1 P11362 3/20 0.61
FGFR4 P22455 3/20 0.61
ABL1 P00519 2/20 0.61
PDGFRB P09619 2/20 0.61
FLT1 P17948 2/20 0.61
FLT4 P35916 2/20 0.61
FGFR2 P21802 2/20 0.61
FGFR3 P22607 2/20 0.61
RIPK2 O43353 1/20 0.61
ERN1 O75460 1/20 0.61
STK10 O94804 1/20 0.61
MAP3K6 O95382 1/20 0.61
ESR1 P03372 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
BCR P11274 1/20 0.61

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
SCHEMBL14437868 0.94 FGFR4 (0.63) KDRRETAURKBPDGFRAKIT
SCHEMBL14437826 0.91 KDR (0.57) KDRRETAURKBPDGFRAKIT
SCHEMBL1892556 0.90 FGFR4 (0.75) KDRRETAURKBPDGFRAKIT
SCHEMBL12503503 0.90 KDR (0.64) KDRRETAURKBPDGFRAKIT
SCHEMBL14437505 0.90 AXL (0.52) KDRRETAURKBPDGFRAKIT
SCHEMBL14437494 0.89 FGFR4 (0.65) KDRRETAURKBPDGFRAKIT
SCHEMBL14437506 0.88 KDR (0.51) KDRRETAURKBPDGFRAKIT
SCHEMBL14693149 0.88 KDR (0.58) KDRRETAURKBPDGFRAKIT
SCHEMBL14437500 0.88 KDR (0.63) KDRRETAURKBPDGFRAKIT
SCHEMBL14437875 0.87 KDR (0.51) KDRRETAURKBPDGFRAKIT

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
US-8372981-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-12 US disclosed