SCHEMBL14779367

SCHEMBL14779367

O=S(=O)(OC1CCCC1OS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
PARL Q9H300 1/20 0.47
ALDH1A1 P00352 5/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ACHE P22303 1/20 0.44
THRB P10828 1/20 0.44
ENPP3 O14638 3/20 0.43
ENPP1 P22413 3/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
GAA P10253 1/20 0.42
MCOLN3 Q8TDD5 1/20 0.42
ENPP2 Q13822 2/20 0.42
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
MMP14 P50281 1/20 0.41

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
SCHEMBL14779168 0.96 ALDH1A1 (0.49) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL14779208 0.92 PARL (0.50) MAPK1PARLALDH1A1NPSR1ENPP3
SCHEMBL2243142 0.88 MAPK1 (0.45) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL14778734 0.88 ACHE (0.46) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL1846584 0.88 MAPK1 (0.45) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL1846583 0.88 MAPK1 (0.45) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL14780257 0.85 ALDH1A1 (0.44) MAPK1PARLALDH1A1NPSR1ACHE
SCHEMBL14778778 0.84 MAPK1 (0.47) MAPK1PARLALDH1A1ACHEENPP3
SCHEMBL2976683 0.84 ALDH1A1 (0.43) MAPK1PARLALDH1A1NPSR1THRB
SCHEMBL2976680 0.84 ALDH1A1 (0.43) MAPK1PARLALDH1A1NPSR1THRB

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