SCHEMBL9958358

SCHEMBL9958358

CS(=O)(=O)Oc1cc2c(cc1OS(C)(=O)=O)CCCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.46
SLC2A1 P11166 1/20 0.44
EP300 Q09472 1/20 0.37
CA7 P43166 2/20 0.37
CDC25B P30305 1/20 0.37
CA2 P00918 2/20 0.36
CA5A P35218 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA14 Q9ULX7 1/20 0.35
TSHR P16473 3/20 0.34
HSD17B10 Q99714 2/20 0.34
ALOX15 P16050 1/20 0.34
DPP4 P27487 1/20 0.34
SCN9A Q15858 1/20 0.33
HTT P42858 2/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL9958008 0.89 STS (0.39) STSSLC2A1EP300CA7CDC25B
SCHEMBL9957342 0.80 NLRP3 (0.33) STSSLC2A1EP300SCN9A
SCHEMBL6184702 0.79 STS (0.68) STSCA7CA2CA5ACA12
SCHEMBL29308778 0.75 STS (0.62) STSCA7CA2CA5ACA12
SCHEMBL9958134 0.75 RXRA (0.43) HTTALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL10567704 0.73 HTR2C (0.42) SMN1; SMN2
SCHEMBL11028656 0.73 CES1 (0.39) STSCA2CA5ATSHRHSD17B10
SCHEMBL59900 0.70 MAPT (0.62) SLC2A1CA7MAPTALDH1A1SMN1; SMN2
SCHEMBL9957908 0.70 PTGS2 (0.31) TSHRHSD17B10SCN9ACYP1A2ALPL
SCHEMBL9958666 0.70 STS (0.37) STSCA2CA5ASCN9AALDH1A1

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