SCHEMBL9957342

SCHEMBL9957342

CS(=O)(=O)Oc1cc2c(c(F)c1F)CCCC2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.33
SLC2A1 P11166 1/20 0.33
STS P08842 1/20 0.33
EP300 Q09472 1/20 0.31
SCN9A Q15858 1/20 0.30

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
SCHEMBL11028656 0.81 CES1 (0.39) STSSCN9A
SCHEMBL9958358 0.80 STS (0.46) SLC2A1STSEP300SCN9A
SCHEMBL9957639 0.79 NLRP3 (0.33) NLRP3STS
SCHEMBL9957908 0.79 PTGS2 (0.31) SCN9A
SCHEMBL9958008 0.78 STS (0.39) SLC2A1STSEP300SCN9A
SCHEMBL9958666 0.75 STS (0.37) NLRP3STSSCN9A
SCHEMBL9958312 0.70 CA1 (0.38)
SCHEMBL9958134 0.70 RXRA (0.43)
SCHEMBL9958701 0.68 PDE4B (0.36)
SCHEMBL21653535 0.68 TSHR (0.35) NLRP3

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
US-9029024-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-05-12 US disclosed
EP-2469638-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE USING THE SAME UBE INDUSTRIES (JP) 2014-10-01 EP disclosed
US-20120189919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
EP-2469638-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-06-27 EP disclosed