SCHEMBL13627457

SCHEMBL13627457

COc1cc2nccc(Oc3ccc(N)c(CF)c3)c2cc1C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.63
MET P08581 7/20 0.63
TEK Q02763 7/20 0.63
AURKB Q96GD4 6/20 0.63
AURKA O14965 5/20 0.63
LCK P06239 3/20 0.56
ABL1 P00519 2/20 0.56
LYN P07948 1/20 0.56
RET P07949 8/20 0.54
PDGFRB P09619 3/20 0.54
PDGFRA P16234 3/20 0.54
KIT P10721 2/20 0.54
FGFR1 P11362 2/20 0.54
FLT1 P17948 2/20 0.54
FLT4 P35916 2/20 0.54
RIPK2 O43353 1/20 0.54
ERN1 O75460 1/20 0.54
STK10 O94804 1/20 0.54
MAP3K6 O95382 1/20 0.54
ESR1 P03372 1/20 0.54

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
SCHEMBL19072656 0.92 KDR (0.66) KDRMETTEKAURKBAURKA
SCHEMBL19072458 0.90 KDR (0.63) KDRMETTEKAURKBAURKA
SCHEMBL12503633 0.87 KDR (0.60) KDRMETTEKAURKBAURKA
SCHEMBL19957430 0.87 KDR (0.74) KDRMETTEKAURKBAURKA
SCHEMBL1893988 0.87 KDR (0.67) KDRMETTEKAURKBAURKA
SCHEMBL1893450 0.85 KDR (0.68) KDRMETTEKAURKBAURKA
SCHEMBL1892459 0.85 KDR (0.64) KDRMETTEKAURKBAURKA
SCHEMBL29624485 0.85 KDR (0.67) KDRMETTEKAURKBAURKA
SCHEMBL1889410 0.85 KDR (0.67) KDRMETTEKAURKBAURKA
Water SCHEMBL19056904 0.84 KDR (0.66) KDRMETTEKAURKBAURKA

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