SCHEMBL15540566

SCHEMBL15540566

CCS(=O)(=O)Nc1ccc(Oc2ccc(OC3COC3)cc2F)c(-c2cn(C)c(=O)cc2OC2COC2)c1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.86

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
SCHEMBL15541719 0.93 BRD4 (1.00) BRD4
SCHEMBL15540657 0.83 BRD4 (0.83) BRD4
SCHEMBL15540276 0.81 BRD4 (0.79) BRD4
SCHEMBL15559218 0.81 BRD4 (0.58) BRD4
SCHEMBL15540475 0.80 BRD4 (0.77) BRD4
SCHEMBL15540478 0.80 BRD4 (0.77) BRD4
SCHEMBL20135814 0.79 BRD4 (0.76) BRD4
SCHEMBL20135836 0.79 BRD4 (0.56) BRD4
SCHEMBL15552612 0.79 BRD4 (0.75) BRD4
SCHEMBL15538566 0.78 BRD4 (1.00) 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-2858990-B1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC (US) 2018-05-16 EP claimed
EP-2858990-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP disclosed
WO-2013188381-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC. (US) 2013-12-19 WO disclosed