SCHEMBL14693153

SCHEMBL14693153

CCN(CC)C[C@@H](O)COc1cc2nccc(Oc3ccc(NC(=O)NC)c(CI)c3)c2cc1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.39
MET P08581 3/20 0.39
KDR P35968 17/20 0.38
PDGFRA P16234 16/20 0.38
KIT P10721 4/20 0.38
FGFR2 P21802 2/20 0.38
FLT4 P35916 5/20 0.37
PDGFRB P09619 4/20 0.37
FLT3 P36888 3/20 0.37
CSF1R P07333 2/20 0.37
RET P07949 4/20 0.37
FLT1 P17948 4/20 0.37
RIPK2 O43353 3/20 0.37
STK10 O94804 3/20 0.37
ABL1 P00519 3/20 0.37
DDR1 Q08345 3/20 0.37
PTK6 Q13882 3/20 0.37
DDR2 Q16832 3/20 0.37
AURKB Q96GD4 3/20 0.37
LCK P06239 2/20 0.37

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
SCHEMBL14693152 0.94 MET (0.39) AXLMETKDRPDGFRAKIT
SCHEMBL14693151 0.91 FGFR4 (0.46) AXLMETKDRPDGFRAKIT
SCHEMBL14693182 0.91 FGFR4 (0.46) AXLMETKDRPDGFRAKIT
SCHEMBL12673523 0.91 KDR (0.46) AXLMETKDRPDGFRAKIT
SCHEMBL2177615 0.90 KDR (0.47) AXLMETKDRPDGFRAKIT
SCHEMBL2177612 0.90 KDR (0.47) AXLMETKDRPDGFRAKIT
SCHEMBL14693173 0.89 KDR (0.41) AXLMETKDRPDGFRAKIT
SCHEMBL14693175 0.87 KDR (0.43) AXLMETKDRPDGFRAKIT
SCHEMBL14693159 0.86 FGFR2 (0.47) AXLMETKDRPDGFRAKIT
SCHEMBL14437733 0.85 MET (0.36) AXLMETKDRPDGFRAFGFR2

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