SCHEMBL15539865

SCHEMBL15539865

Cn1cc(-c2cc(NS(C)(=O)=O)ccc2Oc2ccccc2Cl)ccc1=O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 19/20 0.54
SCN9A Q15858 1/20 0.44

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
SCHEMBL15538778 0.88 BRD4 (0.62) BRD4
SCHEMBL15558311 0.86 BRD4 (0.70) BRD4
SCHEMBL15538643 0.85 BRD4 (0.63) BRD4
SCHEMBL20135856 0.85 BRD4 (0.64) BRD4SCN9A
SCHEMBL15539254 0.84 BRD4 (0.58) BRD4SCN9A
SCHEMBL15540258 0.84 BRD4 (0.56) BRD4SCN9A
SCHEMBL15541470 0.83 BRD4 (0.68) BRD4
SCHEMBL15554200 0.80 BRD4 (0.53) BRD4SCN9A
SCHEMBL15538350 0.79 BRD4 (0.64) BRD4
SCHEMBL15539399 0.78 SLC6A2 (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 4 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-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