SCHEMBL7802744

SCHEMBL7802744

COc1cc2c(O)ncnc2cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.53
▸ RET P07949 12/20 0.50
▸ KDR P35968 9/20 0.50
▸ KIF5B P33176 8/20 0.50
▸ RIPK2 O43353 2/20 0.49
▸ JAK3 P52333 2/20 0.49
▸ GAK O14976 1/20 0.49
▸ STK10 O94804 1/20 0.49
▸ FLT3 P36888 1/20 0.49
▸ AAK1 Q2M2I8 1/20 0.49
▸ Q6ZSR9 Q6ZSR9 1/20 0.49
▸ SLK Q9H2G2 1/20 0.49
▸ IRAK4 Q9NWZ3 1/20 0.49
▸ RPS6KA6 Q9UK32 1/20 0.49
▸ ALK Q9UM73 1/20 0.49
▸ LCK P06239 1/20 0.48
▸ AURKB Q96GD4 2/20 0.47
▸ AURKA O14965 1/20 0.46
▸ ABCB1 P08183 1/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.44

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
SCHEMBL29801726 0.93 EGFR (0.53) EGFRRETKDRKIF5BRIPK2
SCHEMBL216888 0.93 EGFR (0.53) EGFRRETKDRKIF5BRIPK2
Hydrochloric Acid SCHEMBL28006468 0.91 EGFR (0.52) EGFRRETKDRKIF5BRIPK2
SCHEMBL2476964 0.89 RET (0.55) EGFRRETKDRKIF5BRIPK2
SCHEMBL11315816 0.84 EGFR (0.52) EGFRRETKDRKIF5BRIPK2
SCHEMBL20813470 0.84 EGFR (0.52) EGFRRETKDRKIF5BRIPK2
SCHEMBL10296332 0.84 KDR (0.52) EGFRRETKDRKIF5BRIPK2
SCHEMBL10940331 0.83 EGFR (0.52) EGFRRETKDRKIF5BRIPK2
SCHEMBL23500791 0.83 RET (0.43) EGFRRETKDRKIF5BRIPK2
SCHEMBL22323303 0.83 TRPA1 (0.50) EGFRRETKDRKIF5BRIPK2

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-0635498-B1 Quinazoline derivatives and their use as anti-cancer agents SYNGENTA LTD (GB) 2001-04-18 — — EP disclosed
US-5475001-A Quinazoline derivatives ZENECA LIMITED (GB) 1995-12-12 — — US disclosed
WO-1995003283-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS ZENECA LIMITED (GB) 1995-02-02 — — WO disclosed
EP-0635498-A1 Quinazoline derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 — — EP disclosed
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