SCHEMBL1553260

SCHEMBL1553260

Cc1cc(Nc2ncnc3cccc(N)c23)ccc1Oc1ccn2ccnc2c1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 19/20 0.71
EGFR P00533 5/20 0.55
KCNH2 Q12809 2/20 0.45
NQO2 P16083 1/20 0.43
FECH P22830 1/20 0.43
MYH14 Q7Z406 1/20 0.43
RIPK3 Q9Y572 1/20 0.43

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
SCHEMBL21563379 0.90 ERBB2 (0.70) ERBB2EGFRKCNH2
SCHEMBL30097878 0.86 ERBB2 (0.67) ERBB2EGFRNQO2FECHMYH14
SCHEMBL4064521 0.84 ERBB2 (0.59) ERBB2EGFRNQO2FECHMYH14
SCHEMBL21551347 0.84 ERBB2 (1.00) ERBB2EGFR
SCHEMBL21563125 0.81 ERBB2 (0.66) ERBB2EGFR
SCHEMBL24569699 0.81 ERBB2 (0.59) ERBB2EGFRNQO2FECHMYH14
SCHEMBL20780984 0.81 ERBB2 (0.59) ERBB2EGFRNQO2FECHMYH14
SCHEMBL29887942 0.81 ERBB2 (0.59) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24569501 0.80 ERBB2 (0.58) ERBB2EGFRNQO2FECHMYH14
SCHEMBL12873124 0.80 ERBB2 (0.58) ERBB2EGFRNQO2FECHMYH14

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-2090575-B1 Processes and intermediates for the preparation of N4-phenyl-quinazoline-4-amine derivatives ARRAY BIOPHARMA INC (US) 2011-04-27 EP disclosed