SCHEMBL8454429

SCHEMBL8454429

COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OC(C)C1CCCNC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 17/20 0.65
KDR P35968 17/20 0.65
FGFR1 P11362 14/20 0.65
FLT4 P35916 12/20 0.65
EPHB2 P29323 1/20 0.65
EGFR P00533 11/20 0.64
EPHA2 P29317 2/20 0.62
EPHB4 P54760 1/20 0.54
SRC P12931 1/20 0.52

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
SCHEMBL2203010 0.91 FLT1 (0.73) FLT1KDRFGFR1FLT4EPHB2
Hydrochloric Acid SCHEMBL7477739 0.90 FLT1 (0.75) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL5783910 0.84 FLT1 (0.80) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL5428437 0.84 FLT1 (0.80) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL2200924 0.82 KDR (0.74) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL1008026 0.82 KDR (0.72) FLT1KDRFGFR1FLT4EPHB2
Hydrochloric Acid SCHEMBL6454560 0.81 KDR (0.71) FLT1KDRFGFR1FLT4EPHB2
Water SCHEMBL27735443 0.81 KDR (0.71) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL3012896 0.81 KDR (1.00) FLT1KDRFGFR1FLT4EPHB2
SCHEMBL29365791 0.81 KDR (1.00) FLT1KDRFGFR1FLT4EPHB2

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-0929530-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1999-07-21 EP disclosed
WO-1998013354-A1 QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZENECA LIMITED (GB) 1998-04-02 WO disclosed