SCHEMBL7887944

SCHEMBL7887944

COc1cc2ncnc(Nc3cc(-c4ccccc4)[nH]n3)c2cc1OC

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.62
▸ KDR P35968 4/20 0.62
▸ RET P07949 2/20 0.62
▸ LCK P06239 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ RIPK2 O43353 1/20 0.56
▸ EPHB2 P29323 1/20 0.56
▸ FLT1 P17948 1/20 0.55
▸ CLK1 P49759 1/20 0.53
▸ ABCG2 Q9UNQ0 1/20 0.53
▸ ATM Q13315 1/20 0.53

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
Hydrochloric Acid SCHEMBL5561522 0.99 EGFR (0.63) EGFRKDRRETLCKKDM4E
SCHEMBL7876965 0.86 EGFR (0.47) EGFRKDRRETLCKKDM4E
SCHEMBL5567690 0.85 EGFR (0.73) EGFRKDR
Hydrochloric Acid SCHEMBL6444589 0.84 EGFR (0.72) EGFRKDRFLT1
SCHEMBL8704247 0.78 EGFR (0.63) EGFRKDRRETLCKRIPK2
SCHEMBL1257431 0.78 EGFR (1.00) EGFRKDRRETLCKKDM4E
SCHEMBL29515328 0.78 EGFR (1.00) EGFRKDRRETLCKKDM4E
Hydrochloric Acid SCHEMBL8814111 0.77 EGFR (0.85) EGFRKDRRETLCKRIPK2
SCHEMBL7883378 0.77 EGFR (0.48) EGFRKDRRETKDM4EHTT
SCHEMBL7881690 0.77 EGFR (0.48) EGFRKDRRETLCKRIPK2

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-1119567-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2001-08-01 — — EP disclosed
WO-2000021955-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2000-04-20 — — WO disclosed
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