SCHEMBL7215802

SCHEMBL7215802

COC(=O)Oc1cc(Nc2ncnc3cc(NC(=O)CCN4CCOCC4)ccc23)c(F)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.55
ERBB2 P04626 1/20 0.48
MAPK14 Q16539 2/20 0.47
KDR P35968 8/20 0.46
BRAF P15056 4/20 0.46
FGFR1 P11362 3/20 0.46
FLT1 P17948 3/20 0.46
FLT4 P35916 2/20 0.46
AURKA O14965 2/20 0.45
ROCK2 O75116 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LCK P06239 1/20 0.45
FYN P06241 1/20 0.45
RET P07949 1/20 0.45
MET P08581 1/20 0.45
MAPT P10636 1/20 0.45
SRC P12931 1/20 0.45
PDGFRA P16234 1/20 0.45
LTK P29376 1/20 0.45
TTK P33981 1/20 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
SCHEMBL8713014 0.90 EGFR (0.51) EGFRERBB2MAPK14KDRBRAF
SCHEMBL7209951 0.88 EGFR (0.55) EGFRERBB2MAPK14KDRBRAF
SCHEMBL7209619 0.83 EGFR (0.61) EGFRERBB2MAPK14KDRFGFR1
SCHEMBL7451507 0.79 MAPK14 (0.51) EGFRMAPK14KDRFGFR1FLT1
SCHEMBL7209940 0.78 KDR (0.47) EGFRERBB2MAPK14KDRBRAF
Hydrochloric Acid SCHEMBL7209962 0.76 KDR (0.54) EGFRMAPK14KDRBRAFFGFR1
Hydrochloric Acid SCHEMBL7209938 0.75 KDR (0.50) EGFRMAPK14KDRBRAFFGFR1
Hydrochloric Acid SCHEMBL7209973 0.72 GAA (0.49) EGFRKDRBRAFFGFR1FLT1
SCHEMBL5958920 0.72 KDR (0.73) EGFRERBB2KDRBRAFFGFR1
Hydrochloric Acid SCHEMBL7209627 0.71 KDR (0.72) EGFRERBB2MAPK14KDRFGFR1

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