SCHEMBL15438418

SCHEMBL15438418

CC#CC(C)(C(=O)O)P(=O)(OCC)OCC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PPARD Q03181 1/20 0.31
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL15438980 0.83 TSHR (0.36) TSHRALDH1A1
SCHEMBL15438530 0.79
SCHEMBL15438544 0.79 TSHR (0.34) TSHRCA12CA1CA2CA9
SCHEMBL15438111 0.77 TSHR (0.33) TSHRALDH1A1
SCHEMBL15438361 0.76 ALDH1A1 (0.30) ALDH1A1SMN1; SMN2
SCHEMBL15438571 0.72 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL14105288 0.72 TSHR (0.40) TSHRCA12CA1CA2CA9
SCHEMBL10010629 0.72 TSHR (0.39) TSHRALDH1A1
SCHEMBL15438982 0.71 TSHR (0.35) TSHR
SCHEMBL10012710 0.71 TSHR (0.31) TSHRSMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9966632-B2 Non-aqueous electrolyte and power storage device using same UBE INDUSTRIES, LTD. (JP) 2018-05-08 US claimed
EP-2882030-B1 NON-AQUEOUS ELECTROLYTE AND ENERGY STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2017-06-21 EP claimed
US-20150221985-A1 NON-AQUEOUS ELECTROLYTE AND POWER STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2015-08-06 US claimed
EP-2882030-B1 NON-AQUEOUS ELECTROLYTE AND ENERGY STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2017-06-21 EP disclosed
EP-2698859-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICITY-STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2016-07-27 EP disclosed
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US disclosed
US-9318776-B2 Nonaqueous electrolyte solution and electricity storage device using same UBE INDUSTRIES, LTD. (JP) 2016-04-19 US disclosed
US-20150333370-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2015-11-19 US disclosed
EP-2889947-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE Industries, Ltd. (JP) 2015-07-01 EP disclosed
EP-2698859-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME Ube Industries, Ltd. (JP) 2014-02-19 EP disclosed
US-20140030610-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD (JP) 2014-01-30 US disclosed