SCHEMBL1660873

SCHEMBL1660873

COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(Br)ccc4F)c(Cl)c3)c2cc1OC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.76
PDGFRA P16234 14/20 0.68
KIT P10721 2/20 0.66
FLT1 P17948 2/20 0.66
EPHB2 P29323 2/20 0.66
FLT4 P35916 2/20 0.66
RIPK2 O43353 1/20 0.66
STK10 O94804 1/20 0.66
ABL1 P00519 1/20 0.66
LCK P06239 1/20 0.66
LYN P07948 1/20 0.66
RET P07949 1/20 0.66
MET P08581 1/20 0.66
PDGFRB P09619 1/20 0.66
BCR P11274 1/20 0.66
FGFR1 P11362 1/20 0.66
SRC P12931 1/20 0.66
MAPK3 P27361 1/20 0.66
HTR2A P28223 1/20 0.66
MAPK1 P28482 1/20 0.66

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
SCHEMBL1660228 0.92 KDR (0.71) KDRPDGFRAKITFLT1EPHB2
SCHEMBL1660282 0.92 KDR (0.71) KDRPDGFRAKITFLT1EPHB2
SCHEMBL1660249 0.88 KDR (0.67) KDRPDGFRAKITFLT1EPHB2
SCHEMBL1660246 0.88 KDR (0.74) KDRPDGFRAKITFLT1EPHB2
SCHEMBL5205557 0.86 KDR (0.71) KDRPDGFRAKITFLT1EPHB2
SCHEMBL15962876 0.84 KDR (0.69) KDRPDGFRAKITFLT1EPHB2
SCHEMBL1660426 0.84 KDR (0.82) KDRPDGFRAKITFLT1EPHB2
SCHEMBL1659143 0.84 KDR (0.79) KDRPDGFRAKITFLT1EPHB2
SCHEMBL15962761 0.84 KDR (0.79) KDRPDGFRAKITFLT1EPHB2
SCHEMBL5204741 0.84 KDR (0.85) KDRPDGFRAKITFLT1EPHB2

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
WO-2011046991-A2 CERTAIN SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT, INC. (US) 2011-04-21 WO disclosed