SCHEMBL14779352

SCHEMBL14779352

CCCC(OS(=O)(=O)c1ccc(C)cc1)C(C)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.50
CA9 Q16790 3/20 0.50
CA12 O43570 2/20 0.50
TLR9 Q9NR96 1/20 0.39
ALDH1A1 P00352 5/20 0.39
GAA P10253 1/20 0.38
GBA1 P04062 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
DHODH Q02127 1/20 0.36
VDR P11473 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA1 P00915 3/20 0.36
CYP24A1 Q07973 1/20 0.36
CA7 P43166 2/20 0.36
CA3 P07451 1/20 0.36

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
SCHEMBL14779875 0.92 CA12 (0.50) CA2CA9CA12TLR9ALDH1A1
SCHEMBL14780206 0.91 CA12 (0.44) CA2CA9CA12TLR9ALDH1A1
SCHEMBL5275738 0.90 CA2 (0.50) CA2CA9CA12ALDH1A1GAA
SCHEMBL14778708 0.89 CA12 (0.43) CA2CA9CA12TLR9ALDH1A1
SCHEMBL14780014 0.88 CA2 (0.42) CA2CA9CA12TLR9ALDH1A1
SCHEMBL14779807 0.88 MCHR1 (0.43) CA2CA9CA12TLR9ALDH1A1
SCHEMBL14778474 0.85 SMN1; SMN2 (0.49) CA2CA9CA12ALDH1A1CYP2C9
SCHEMBL25461788 0.83 CA2 (0.53) CA2CA9CA12TLR9ALDH1A1
SCHEMBL4203498 0.83 CA2 (0.53) CA2CA9CA12TLR9ALDH1A1
SCHEMBL3634964 0.83 CA2 (0.53) CA2CA9CA12TLR9ALDH1A1

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 6 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 claimed
EP-2579377-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES (JP) 2014-09-03 EP claimed
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