SCHEMBL15225655

SCHEMBL15225655

C=C(O)c1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2s1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.44
MET P08581 13/20 0.44
HSPB1 P04792 4/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FLT1 P17948 1/20 0.39

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
SCHEMBL3560489 0.91 KDR (0.47) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL27811860 0.89 KDR (0.47) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL3566289 0.88 KDR (0.44) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL13168660 0.88 KDR (0.44) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL3573701 0.86 KDR (0.55) KDRMETALDH1A1MAPTMAPK1
SCHEMBL3566451 0.85 KDR (0.55) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL14771341 0.83 KDR (0.47) KDRMETFLT1
SCHEMBL307973 0.83 KDR (0.47) KDRMETHSPB1ALDH1A1MAPT
SCHEMBL3562646 0.83 KDR (0.48) KDRMETFLT1
SCHEMBL3562636 0.83 KDR (0.48) KDRMETFLT1

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-1781664-B1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC (CA) 2013-09-04 EP disclosed