SCHEMBL5754345

SCHEMBL5754345

COc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCC(O)CN1CCN(CCO)CC1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 17/20 0.69
KDR P35968 17/20 0.69
FGFR1 P11362 16/20 0.69
EGFR P00533 12/20 0.69
FLT4 P35916 11/20 0.69
EPHB2 P29323 1/20 0.63
EPHA2 P29317 1/20 0.58
EPHB4 P54760 1/20 0.58

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
SCHEMBL5460598 0.95 KDR (0.70) FLT1KDRFGFR1EGFRFLT4
Hydrochloric Acid SCHEMBL5445575 0.95 KDR (0.72) FLT1KDRFGFR1EGFRFLT4
SCHEMBL5757192 0.94 KDR (0.77) FLT1KDRFGFR1EGFRFLT4
SCHEMBL14564687 0.94 KDR (0.77) FLT1KDRFGFR1EGFRFLT4
SCHEMBL5458850 0.92 EGFR (0.78) FLT1KDRFGFR1EGFRFLT4
SCHEMBL5456122 0.92 FLT1 (0.72) FLT1KDRFGFR1EGFRFLT4
SCHEMBL5755914 0.92 FLT1 (0.75) FLT1KDRFGFR1EGFRFLT4
SCHEMBL14564686 0.92 FLT1 (0.75) FLT1KDRFGFR1EGFRFLT4
Hydrochloric Acid SCHEMBL5453620 0.92 EGFR (0.76) FLT1KDRFGFR1EGFRFLT4
SCHEMBL5460591 0.92 EGFR (0.67) FLT1KDRFGFR1EGFRFLT4

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-1274692-B1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2006-08-02 EP claimed