SCHEMBL16239703

SCHEMBL16239703

COc1cc(C(=O)NS(C)(=O)=O)ccc1COc1ccc(Cl)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.67
HDAC8 Q9BY41 2/20 0.64
SCN5A Q14524 3/20 0.60

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
SCHEMBL363727 0.89 SCN9A (0.64) SCN9AHDAC8SCN5A
SCHEMBL16239966 0.84 HDAC8 (0.65) SCN9AHDAC8SCN5A
Diethylamine SCHEMBL16239800 0.84 SCN9A (0.59) SCN9AHDAC8SCN5A
SCHEMBL366237 0.83 HDAC8 (0.51) SCN9AHDAC8SCN5A
SCHEMBL366085 0.83 SCN9A (0.58) SCN9AHDAC8SCN5A
SCHEMBL16239813 0.83 HDAC8 (0.63) SCN9AHDAC8
SCHEMBL680292 0.82 SCN9A (0.65) SCN9ASCN5A
SCHEMBL680427 0.82 SCN9A (0.59) SCN9ASCN5A
SCHEMBL16240196 0.82 SCN9A (0.77) SCN9ASCN5A
SCHEMBL16618352 0.81 SCN9A (1.00) SCN9ASCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593428-B1 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS PFIZER LTD (GB) 2014-11-19 EP disclosed