SCHEMBL1417833

SCHEMBL1417833

CCOC(=O)CN1CCN(CCCNC(=O)C=CC(=O)Nc2ccc3ncnc(Nc4cccc(Br)c4)c3c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.67
ERBB2 P04626 10/20 0.66

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
SCHEMBL1417831 1.00 EGFR (0.67) EGFRERBB2
SCHEMBL1418184 0.89 EGFR (0.61) EGFRERBB2
SCHEMBL1418187 0.89 EGFR (0.61) EGFRERBB2
SCHEMBL1417996 0.88 EGFR (0.76) EGFRERBB2
SCHEMBL1417994 0.88 EGFR (0.76) EGFRERBB2
SCHEMBL1418682 0.84 EGFR (0.64) EGFRERBB2
SCHEMBL1418677 0.84 EGFR (0.64) EGFRERBB2
SCHEMBL6504936 0.84 EGFR (0.78) EGFRERBB2
SCHEMBL6504935 0.84 EGFR (0.78) EGFRERBB2
SCHEMBL2990560 0.81 EGFR (1.00) EGFRERBB2

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
EP-2298746-A1 4-amino- quinazoline and quinoline derivatives having an inhibitory effect on signal transduction mediated by tyrosine kinases Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2011-03-23 EP disclosed
US-6972288-B1 4-amino-quinazoline and quinoline derivatives having an inhibitory effect on signal transduction mediated by tyrosine kinases BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-12-06 US disclosed
EP-1157011-A1 4-AMINO- QUINAZOLINE AND QUINOLINE DERIVATIVES HAVING AN INHIBITORY EFFECT ON SIGNAL TRANSDUCTION MEDIATED BY TYROSINE KINASES Boehringer Ingelheim Pharma KG (DE) 2001-11-28 EP disclosed
WO-2000051991-A1 4-AMINO-QUINAZOLINE AND QUINOLINE DERIVATIVES HAVING AN INHIBITORY EFFECT ON SIGNAL TRANsSDUCTION MEDIATED BY TYROSINE KINASES BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-09-08 WO disclosed