SCHEMBL20216832

SCHEMBL20216832

COc1cc2c(Oc3ncc(NC=O)cc3Cl)ccnc2cc1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ EPHA2 P29317 1/20 0.49
▸ EPHB4 P54760 1/20 0.49
▸ FGFR2 P21802 2/20 0.48
▸ MET P08581 6/20 0.47
▸ EGFR P00533 2/20 0.47
▸ PDPK1 O15530 1/20 0.47
▸ PDGFRA P16234 3/20 0.46
▸ AXL P30530 1/20 0.46
▸ MERTK Q12866 1/20 0.46
▸ SRC P12931 1/20 0.46
▸ TGFBR1 P36897 1/20 0.46
▸ KIT P10721 1/20 0.45

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
SCHEMBL19372984 0.90 KDR (0.51) KDRFLT1EPHA2EPHB4FGFR2
SCHEMBL19372928 0.89 PDGFRA (0.54) KDRFGFR2PDGFRAAXLMERTK
SCHEMBL24520223 0.84 KDR (0.53) KDRFLT1EPHA2EPHB4FGFR2
SCHEMBL22566436 0.81 MET (0.61) KDRFGFR2METAXL
SCHEMBL5001922 0.80 AXL (0.53) KDRMETPDGFRAAXLMERTK
SCHEMBL372090 0.80 AXL (0.76) KDRFLT1EPHA2METEGFR
SCHEMBL6592222 0.79 KDM1A (0.56) FGFR2EGFRPDPK1PDGFRA
SCHEMBL10296328 0.79 KDM1A (0.56) FGFR2EGFRPDPK1PDGFRA
SCHEMBL371747 0.79 MET (0.55) KDRMETPDGFRAAXLMERTK
SCHEMBL371670 0.78 MET (0.60) KDRMETPDGFRAAXLMERTK

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
EP-3329918-A2 C-MET MODULATORS AND METHODS OF USE Exelixis, Inc. (US) 2018-06-06 — — EP disclosed
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