SCHEMBL13613014

SCHEMBL13613014

COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4)c(Cl)c3)c2cc1OCN

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.74
PDGFRA P16234 18/20 0.71
KIT P10721 2/20 0.64
FGFR2 P21802 1/20 0.64
AXL P30530 1/20 0.64
RIPK2 O43353 1/20 0.62
STK10 O94804 1/20 0.62
ABL1 P00519 1/20 0.62
LCK P06239 1/20 0.62
LYN P07948 1/20 0.62
RET P07949 1/20 0.62
MET P08581 1/20 0.62
PDGFRB P09619 1/20 0.62
BCR P11274 1/20 0.62
FGFR1 P11362 1/20 0.62
SRC P12931 1/20 0.62
FLT1 P17948 1/20 0.62
MAPK3 P27361 1/20 0.62
HTR2A P28223 1/20 0.62
MAPK1 P28482 1/20 0.62

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
SCHEMBL6864391 0.89 KDR (0.83) KDRPDGFRAKITFGFR2AXL
SCHEMBL14423796 0.88 KDR (0.88) KDRPDGFRAKITFGFR2AXL
SCHEMBL5204147 0.88 KDR (0.84) KDRPDGFRAKITRIPK2STK10
SCHEMBL1895176 0.88 KDR (0.72) KDRPDGFRAKITFGFR2AXL
Hydrochloric Acid SCHEMBL5202398 0.87 KDR (0.82) KDRPDGFRAKITRIPK2STK10
SCHEMBL13613029 0.87 KDR (0.66) KDRPDGFRAKITFGFR2AXL
SCHEMBL5125963 0.86 KDR (0.85) KDRPDGFRAKITFGFR2AXL
SCHEMBL1880429 0.85 KDR (0.77) KDRPDGFRAKITFGFR2AXL
SCHEMBL5204741 0.85 KDR (0.85) KDRPDGFRAKITFGFR2AXL
SCHEMBL13613040 0.85 KDR (0.63) KDRPDGFRAKITFGFR2AXL

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-7612092-B2 Urea derivatives containing aromatic or heteroaromatic rings; 4-(3-chloro-4-(cyclopropylaminocarbonyl)aminophenoxy)-7-methoxy-6-quinolinecarboxamide; prophylactic or therapeutic agent for a disease for which angiogenesis inhibition is effective EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed