SCHEMBL4580284

SCHEMBL4580284

CN(C)CC(=O)NCCCCOc1cc2ncnc(Nc3ccc(Br)cc3F)c2cc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.68
KDR P35968 20/20 0.68

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
SCHEMBL4578315 0.95 EGFR (0.71) EGFRKDR
SCHEMBL4577760 0.90 EGFR (0.70) EGFRKDR
SCHEMBL4578761 0.89 EGFR (0.67) EGFRKDR
SCHEMBL4578763 0.89 EGFR (0.67) EGFRKDR
SCHEMBL4577692 0.89 EGFR (0.60) EGFRKDR
SCHEMBL4577813 0.89 EGFR (0.62) EGFRKDR
SCHEMBL4599470 0.89 EGFR (0.72) EGFRKDR
SCHEMBL4577710 0.88 EGFR (0.71) EGFRKDR
SCHEMBL4579003 0.88 EGFR (0.58) EGFRKDR
SCHEMBL5103549 0.88 KDR (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951686-A1 QUINAZOLINE DERIVATIVES AS A MULTIPLEX INHIBITOR AND METHOD FOR THE PREPARATION THEREOF Hanmi Pharm. Co., Ltd. (KR) 2008-08-06 EP disclosed
WO-2007055514-A1 QUINAZOLINE DERIVATIVES AS A MULTIPLEX INHIBITOR AND METHOD FOR THE PREPARATION THEREOF HANMI PHARM. CO., LTD. (KR) 2007-05-18 WO disclosed