SCHEMBL7950678

SCHEMBL7950678

O=C1Cc2cc(O)c(CO)cc2C=CN1CCCCl

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33

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
SCHEMBL8269502 0.91 BRD4 (0.35) BRD4
SCHEMBL13615982 0.83 BRD4 (0.33) BRD4
SCHEMBL6846096 0.79 BRD4 (0.35) BRD4
SCHEMBL14845339 0.79 BRD4 (0.38) BRD4
SCHEMBL10977762 0.78 BRD4 (0.40) BRD4
SCHEMBL8277866 0.76 BRD4 (0.37) BRD4
SCHEMBL30285155 0.75 BRD4 (0.63) BRD4
SCHEMBL2450139 0.75 BRD4 (0.63) BRD4
SCHEMBL15044209 0.74 BRD4 (0.32) BRD4
SCHEMBL12332636 0.72 HCN4 (0.55) BRD4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2135861-A1 Process for the synthesis of the 7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one, and its application to the synthesis of ivabradine as well as its addition salts with a pharmaceutically acceptable acid Les Laboratoires Servier (FR) 2009-12-23 EP disclosed
WO-2009153461-A2 NOVEL METHOD FOR THE SYNTHESIS OF 7,8-DIMETHOXY-1,3-DIHYDRO-2H-3-BENZAZEPIN-2-ONE, AND USE IN THE SYNTHESIS OF IVABRADINE AND OF ADDITION SALTS THEREOF WITH A PHARMACEUTICALLY ACCEPTABLE ACID LES LABORATOIRES SERVIER (FR) 2009-12-23 WO disclosed
EP-1589014-B1 Process for the preparation of 1,3-dihydro-2H-3-benzazepin-2-one and application to the preparation of ivabradine and their pharmaceutically acceptable salts SERVIER LAB (FR) 2007-10-10 EP disclosed