SCHEMBL7688302

SCHEMBL7688302

COc1ccc2c(Oc3ccc(C[C@@H](CO)N(Cc4ccccc4)C[C@H](O)c4ccc(OCc5ccccc5)c(N)c4)cc3)ccnc2c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 1/20 0.37
MET P08581 17/20 0.36
KDR P35968 8/20 0.36
AURKA O14965 2/20 0.36
TEK Q02763 2/20 0.36
AURKB Q96GD4 1/20 0.36
CYP3A4 P08684 3/20 0.36
TLR8 Q9NR97 1/20 0.36
PRKACG P22612 1/20 0.36
IGF1R P08069 6/20 0.34

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
SCHEMBL7688304 1.00 PDGFRA (0.37) PDGFRAMETKDRAURKATEK
SCHEMBL7692700 0.92 LPAR1 (0.33) PDGFRAMETKDR
SCHEMBL7692701 0.92 LPAR1 (0.33) PDGFRAMETKDR
SCHEMBL7693295 0.90 BRAF (0.34) KDR
SCHEMBL7691909 0.89 KDR (0.36) PDGFRAMETKDRAURKATEK
SCHEMBL7691911 0.89 KDR (0.36) PDGFRAMETKDRAURKATEK
SCHEMBL6479054 0.88 LPAR1 (0.34) METKDR
SCHEMBL6479065 0.88 LPAR1 (0.34) METKDR
SCHEMBL7245302 0.87 OPRD1 (0.39)
SCHEMBL7245309 0.87 OPRD1 (0.39)

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-2002000622-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed