SCHEMBL6017201

SCHEMBL6017201

CN(C)CC(=O)N1CCCC(Oc2ccc3ncnc(Nc4ccc(OCc5ccccn5)c(Cl)c4)c3c2)C1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.63
ERBB2 P04626 12/20 0.58
LCK P06239 1/20 0.58
KCNH2 Q12809 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
SCHEMBL5567889 1.00 EGFR (0.63) EGFRERBB2LCKKCNH2
SCHEMBL5564723 0.93 EGFR (0.63) EGFRERBB2LCKKCNH2
SCHEMBL6017179 0.92 EGFR (0.62) EGFRERBB2LCKKCNH2
SCHEMBL5564331 0.92 EGFR (0.62) EGFRERBB2LCKKCNH2
SCHEMBL5566166 0.89 EGFR (0.67) EGFRERBB2LCKKCNH2
SCHEMBL5569400 0.86 EGFR (0.65) EGFRERBB2LCK
SCHEMBL6017522 0.86 EGFR (0.65) EGFRERBB2LCK
SCHEMBL5564685 0.85 EGFR (0.67) EGFRERBB2LCKKCNH2
SCHEMBL5564542 0.85 EGFR (0.58) EGFRERBB2LCKKCNH2
SCHEMBL5567987 0.85 EGFR (0.63) EGFRERBB2LCKKCNH2

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-1664028-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026151-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 WO disclosed