SCHEMBL7209959

SCHEMBL7209959

COc1cc2c(Nc3cc(OCc4ccccc4)c(C)cc3F)ncnc2cc1OCCO

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.60
FLT1 P17948 6/20 0.60
FGFR1 P11362 4/20 0.60
RET P07949 3/20 0.60
KIF5B P33176 3/20 0.60
EGFR P00533 6/20 0.57
MEN1 O00255 1/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.56
MAPK14 Q16539 1/20 0.55
AURKB Q96GD4 1/20 0.55
IRAK4 Q9NWZ3 1/20 0.55
FLT4 P35916 2/20 0.54
FGFR2 P21802 1/20 0.54
FGFR4 P22455 1/20 0.54
FGFR3 P22607 1/20 0.54
HDAC3 O15379 4/20 0.54
HDAC4 P56524 4/20 0.54
HDAC1 Q13547 4/20 0.54
HDAC7 Q8WUI4 4/20 0.54

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
SCHEMBL7215792 0.89 EGFR (0.56) KDRFLT1FGFR1RETKIF5B
SCHEMBL7214413 0.87 KDR (0.65) KDRFLT1FGFR1RETKIF5B
SCHEMBL7452840 0.87 KDR (0.79) KDRFLT1FGFR1RETKIF5B
SCHEMBL7211052 0.87 EGFR (0.59) KDRFLT1FGFR1RETKIF5B
SCHEMBL7215843 0.87 EGFR (0.59) KDRFLT1FGFR1RETKIF5B
Hydrochloric Acid SCHEMBL7454416 0.86 KDR (0.78) KDRFLT1FGFR1RETKIF5B
Hydrochloric Acid SCHEMBL7454404 0.86 EGFR (0.58) KDRFLT1FGFR1RETKIF5B
SCHEMBL7214452 0.84 KDR (0.84) KDRFLT1FGFR1RETKIF5B
Hydrochloric Acid SCHEMBL2139091 0.82 EGFR (0.67) KDRFLT1FGFR1RETKIF5B
SCHEMBL7455732 0.81 KDR (0.75) KDRFLT1FGFR1RETKIF5B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0880508-B1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2003-04-16 EP disclosed
US-6184225-B1 ENDOTHELIAL GROWTH FACTOR INHIBITORS, ANGIOGENESIS INHIBITORS ZENECA LIMITED (GB) 2001-02-06 US disclosed
EP-0880508-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
WO-1997030035-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1997-08-21 WO disclosed