SCHEMBL8976587

SCHEMBL8976587

COc1cc2ncnc(Nc3cnc4ccccc4c3)c2cc1OC

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.70
KDR P35968 5/20 0.70
RET P07949 3/20 0.70
LCK P06239 4/20 0.69
SRC P12931 1/20 0.65
CLK1 P49759 1/20 0.63
ABCG2 Q9UNQ0 1/20 0.63
RIPK2 O43353 1/20 0.62
EPHB2 P29323 1/20 0.62
FLT1 P17948 1/20 0.60

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
SCHEMBL6181200 0.85 EGFR (0.74) EGFRKDRRETLCKSRC
SCHEMBL8976743 0.84 EGFR (0.69) EGFRKDRRETLCKSRC
Hydrochloric Acid SCHEMBL6180787 0.84 EGFR (0.74) EGFRKDRRETLCKSRC
SCHEMBL29515328 0.83 EGFR (1.00) EGFRKDRRETLCKSRC
SCHEMBL1257431 0.83 EGFR (1.00) EGFRKDRRETLCKSRC
Hydrochloric Acid SCHEMBL5475737 0.82 EGFR (1.00) EGFRKDRRETLCKSRC
SCHEMBL28966438 0.81 IGF1R (0.51) EGFRKDRRETLCKSRC
SCHEMBL1387182 0.81 EGFR (0.94) EGFRKDRRETLCKSRC
SCHEMBL3895212 0.81 EGFR (0.63) EGFRKDRLCKSRCRIPK2
SCHEMBL6679533 0.80 HTT (0.69) EGFRKDR

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
US-5580870-A ANTICARCINOGENIC AGENTS ZENECA LIMITED (GB) 1996-12-03 US disclosed
EP-0602851-B1 Quinazoline derivatives ZENECA LTD (GB) 1996-10-09 EP disclosed
CN-1094043-A Quinazoline derivant ZENECA LTD (GB) 1994-10-26 CN disclosed
EP-0602851-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1994-06-22 EP disclosed