SCHEMBL14778281

SCHEMBL14778281

CCCCCCS(=O)(=O)OC(C)C(C)OS(=O)(=O)CCCCCC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.47
FAAH O00519 2/20 0.46
CES1 P23141 4/20 0.39
CA1 P00915 7/20 0.38
CA9 Q16790 6/20 0.38
CA12 O43570 3/20 0.38
CA7 P43166 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA5B Q9Y2D0 2/20 0.38

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
SCHEMBL14778402 0.98 CA2 (0.44) CA2FAAHCES1CA1CA9
SCHEMBL14779696 0.92 CA2 (0.44) CA2FAAHCES1CA1CA9
SCHEMBL14780020 0.91 CA2 (0.39) CA2FAAHCA1CA9CA12
SCHEMBL14777687 0.89 CA2 (0.41) CA2FAAHCES1CA1CA9
SCHEMBL28224982 0.87 CA2 (0.47) CA2FAAHCES1CA1CA9
SCHEMBL28014312 0.87 CA2 (0.47) CA2FAAHCES1CA1CA9
SCHEMBL28150641 0.87 CA2 (0.47) CA2FAAHCES1CA1CA9
SCHEMBL14779204 0.87 CA2 (0.41) CA2FAAHCES1CA1CA9
Fluoride SCHEMBL28152969 0.85 CA2 (0.46) CA2FAAHCES1CA1CA9
SCHEMBL14778480 0.84 CA2 (0.38) CA2FAAHCES1CA1CA9

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-9240614-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2016-01-19 US disclosed
EP-2579377-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES (JP) 2014-09-03 EP disclosed
EP-2579377-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2013-04-10 EP disclosed
US-20130071733-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2013-03-21 US disclosed