SCHEMBL5320281

SCHEMBL5320281

N#Cc1c(N)ncnc1Nc1ccc(OCc2cccc(F)c2)c(Cl)c1

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.80
ERBB2 P04626 16/20 0.80
ERBB3 P21860 1/20 0.64
ERBB4 Q15303 1/20 0.64
GAK O14976 1/20 0.62

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
SCHEMBL1095949 0.89 EGFR (1.00) EGFRERBB2
SCHEMBL5524423 0.84 EGFR (0.80) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL14467425 0.84 EGFR (0.76) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL2748379 0.82 EGFR (0.69) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL1105295 0.82 EGFR (0.82) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL28347182 0.82 EGFR (0.74) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL5002100 0.82 EGFR (0.82) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL5002106 0.82 EGFR (0.82) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL233913 0.82 EGFR (0.77) EGFRERBB2ERBB3ERBB4GAK
SCHEMBL12694678 0.80 EGFR (1.00) EGFRERBB2ERBB3ERBB4GAK

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
WO-2007081630-A2 SUBSTITUTED PYRIMIDINYL KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-19 WO disclosed