SCHEMBL5790844

SCHEMBL5790844

COc1cc2ncnc(Oc3ccc4oc(Nc5ccc(Cl)c(O[C@@H](C)C6CCCN6)c5)nc4c3)c2cc1OC

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.66
EPHA2 P29317 4/20 0.43
EPHB4 P54760 3/20 0.43
ERBB2 P04626 1/20 0.43
KIT P10721 3/20 0.42
PDGFRA P16234 2/20 0.42
LCK P06239 1/20 0.42
CSF1R P07333 1/20 0.42
IGF1R P08069 1/20 0.42
MET P08581 1/20 0.42
FGFR1 P11362 1/20 0.42
SRC P12931 1/20 0.42
FGFR2 P21802 1/20 0.42
FGFR4 P22455 1/20 0.42
FGFR3 P22607 1/20 0.42
TEK Q02763 1/20 0.42
RAF1 P04049 1/20 0.40
BRAF P15056 1/20 0.40
EGFR P00533 1/20 0.40

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
SCHEMBL4367885 1.00 KDR (0.66) KDREPHA2EPHB4ERBB2KIT
SCHEMBL5792275 0.91 KDR (0.66) KDRKITPDGFRALCKCSF1R
SCHEMBL4367202 0.91 KDR (0.66) KDRKITPDGFRALCKCSF1R
SCHEMBL4368117 0.84 KDR (0.51) KDRKITPDGFRARAF1BRAF
SCHEMBL4362218 0.82 KDR (0.58) KDRKITLCKCSF1RIGF1R
SCHEMBL5788446 0.82 KDR (0.53) KDRKITLCKCSF1RIGF1R
SCHEMBL5790847 0.82 KDR (0.53) KDRKITLCKCSF1RIGF1R
SCHEMBL4364753 0.81 KDR (0.49) KDRKITLCKCSF1RIGF1R
SCHEMBL4369696 0.80 KDR (1.00) KDREPHA2EPHB4ERBB2KIT
SCHEMBL4367877 0.80 KDR (1.00) KDREPHA2EPHB4ERBB2KIT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 EP disclosed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 WO disclosed