SCHEMBL15539796

SCHEMBL15539796

Cc1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2cccnc2)c[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.56
EP300 Q09472 4/20 0.49
BRD2 P25440 1/20 0.45
SMARCA2 P51531 1/20 0.45
BRD3 Q15059 1/20 0.45
BRDT Q58F21 1/20 0.45
CREBBP Q92793 1/20 0.45
BRWD1 Q9NSI6 1/20 0.45
BAZ2A Q9UIF9 1/20 0.45

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
SCHEMBL15538092 0.89 BRD4 (0.65) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15540255 0.84 BRD4 (0.51) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15540131 0.84 BRD4 (0.51) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15537716 0.83 BRD4 (0.52) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15541612 0.83 BRD4 (0.62) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15538083 0.83 BRD4 (0.62) BRD4EP300
SCHEMBL15537932 0.82 BRD4 (0.48) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15537533 0.82 BRD4 (0.48) BRD4EP300BRD2SMARCA2BRD3
SCHEMBL15541159 0.81 BRD4 (0.62) BRD4EP300
SCHEMBL15538914 0.80 SLC6A2 (0.54) BRD4EP300BRD2SMARCA2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2858982-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP claimed
WO-2013185284-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBOTT LABORATORIES (US) 2013-12-19 WO claimed
EP-2858990-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP disclosed
EP-2858982-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES AbbVie Inc. (US) 2015-04-15 EP disclosed
WO-2013185284-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBOTT LABORATORIES (US) 2013-12-19 WO disclosed
WO-2013188381-A1 PYRIDINONE AND PYRIDAZINONE DERIVATIVES ABBVIE INC. (US) 2013-12-19 WO disclosed