SCHEMBL16319357

SCHEMBL16319357

COc1cc(Cl)cc(Oc2cc(F)c(C(=O)NS(C)(=O)=O)cc2F)c1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.67
SCN5A Q14524 3/20 0.49
SCN1A P35498 2/20 0.49
ABCB11 O95342 1/20 0.49
CYP2C9 P11712 1/20 0.49
SCN4A P35499 1/20 0.49
SCN2A Q99250 1/20 0.49
SCN3A Q9NY46 1/20 0.49
SCN8A Q9UQD0 1/20 0.49
SCN10A Q9Y5Y9 1/20 0.49
SCN2B O60939 1/20 0.49
SCN1B Q07699 1/20 0.49

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
SCHEMBL680161 0.93 SCN9A (0.72) SCN9ASCN5ASCN1ASCN2BSCN1B
SCHEMBL16319449 0.91 SCN9A (0.63) SCN9ASCN5ASCN1AABCB11CYP2C9
SCHEMBL16319498 0.88 SCN9A (0.67) SCN9ASCN5ASCN1ASCN2BSCN1B
SCHEMBL680467 0.85 SCN9A (0.72) SCN9ASCN5ASCN1AABCB11CYP2C9
SCHEMBL680553 0.85 SCN9A (0.68) SCN9A
SCHEMBL679946 0.84 SCN9A (0.78) SCN9ASCN5ASCN1ASCN2BSCN1B
SCHEMBL679897 0.84 SCN9A (0.73) SCN9ASCN5ASCN1ASCN2BSCN1B
SCHEMBL1690270 0.83 SCN9A (0.65) SCN9ASCN5ASCN1AABCB11CYP2C9
SCHEMBL679997 0.83 SCN9A (0.68) SCN9ASCN5ASCN1ASCN2BSCN1B
SCHEMBL680391 0.83 SCN9A (0.68) SCN9ASCN5ASCN1ASCN2BSCN1B

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-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed