SCHEMBL7476474

SCHEMBL7476474

COc1cc2c(Nc3ccc(C)cc3F)ncnc2cc1OC(C(=O)OC(C)(C)C)C1CCNCC1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.63
FLT1 P17948 11/20 0.63
FGFR1 P11362 9/20 0.63
EGFR P00533 8/20 0.63
FLT4 P35916 6/20 0.63
RET P07949 4/20 0.48
KIF5B P33176 4/20 0.48
EPHB2 P29323 1/20 0.47
RAF1 P04049 1/20 0.46
BRAF P15056 1/20 0.46
EPHA2 P29317 2/20 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
SCHEMBL4604150 0.93 KDR (0.64) KDRFLT1FGFR1EGFRFLT4
SCHEMBL2200924 0.85 KDR (0.74) KDRFLT1FGFR1EGFRFLT4
SCHEMBL7482777 0.85 KDR (0.62) KDRFLT1FGFR1EGFRFLT4
SCHEMBL5912648 0.79 ENPP1 (0.43) KDRFLT1FGFR1EGFRFLT4
SCHEMBL2136908 0.78 EGFR (1.00) KDRFLT1FGFR1EGFRFLT4
Trifluoroacetic Acid SCHEMBL6902285 0.78 KDR (0.65) KDRFLT1FGFR1EGFRFLT4
SCHEMBL1008026 0.77 KDR (0.72) KDRFLT1FGFR1EGFRFLT4
SCHEMBL7866068 0.77 KDR (0.80) KDRFLT1FGFR1EGFRFLT4
Hydrochloric Acid SCHEMBL6454560 0.76 KDR (0.71) KDRFLT1FGFR1EGFRFLT4
SCHEMBL2203010 0.76 FLT1 (0.73) KDRFLT1FGFR1EGFRFLT4

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-1244647-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS AstraZeneca AB (SE) 2002-10-02 EP disclosed
WO-2001032651-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2001-05-10 WO disclosed