SCHEMBL1875311

SCHEMBL1875311

NS(=O)(=O)CCC(c1cscn1)c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 18/20 0.42
▸ SCN5A Q14524 18/20 0.42
▸ SCN8A Q9UQD0 18/20 0.42
▸ SCN1B Q07699 3/20 0.40
▸ SCN9A Q15858 2/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ SCN2A Q99250 1/20 0.40
▸ IDO1 P14902 1/20 0.32
▸ TDO2 P48775 1/20 0.32

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
SCHEMBL1876712 0.83 SLC6A3 (0.40) SCN1ASCN5ASCN8ASCN1BSCN2A
SCHEMBL1875309 0.70 SCN1A (0.42) SCN1ASCN5ASCN8ASCN1BSCN9A
SCHEMBL7396037 0.63 HRH1 (0.52) —
SCHEMBL7297048 0.62 SLC6A2 (0.42) SCN1ACYP2C9SCN2AIDO1TDO2
SCHEMBL9281512 0.61 IDO1 (0.40) IDO1TDO2
SCHEMBL6001389 0.61 HRH1 (0.54) IDO1TDO2
SCHEMBL2319920 0.60 CES2 (0.42) IDO1TDO2
SCHEMBL2322514 0.60 CES2 (0.42) IDO1TDO2
SCHEMBL2320175 0.60 CES2 (0.42) IDO1TDO2
SCHEMBL5503117 0.60 SLC6A3 (0.43) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2498608-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GlaxoSmithKline LLC (US) 2012-09-19 — — EP disclosed
WO-2011059610-A1 BENZENE SULFONAMIDE THIAZOLE AND OXAZOLE COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-05-19 — — WO disclosed
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