SCHEMBL2105595

SCHEMBL2105595

C#CC(OS(=O)OC(C#C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.31
KCNN4 O15554 3/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL27692053 0.85 CYP1A2 (0.35) TSHRCYP1A2KCNN4CYP2D6CYP2C9
SCHEMBL2105418 0.77 MAPK1 (0.38) TSHRCYP1A2MAPK1KCNN4CYP2C19
SCHEMBL2105611 0.73 CA1 (0.36) TSHRCYP1A2MAPK1KCNN4CYP2C19
SCHEMBL28724152 0.72 TSHR (0.39) TSHRMAPK1KCNN4ALDH1A1
SCHEMBL24133123 0.72 TSHR (0.34) TSHRMAPK1KCNN4ALDH1A1
SCHEMBL2105596 0.72 KCNN4 (0.38) TSHRCYP1A2KCNN4CYP2D6CYP2C19
SCHEMBL2105137 0.72 TSHR (0.34) TSHRMAPK1KCNN4ALDH1A1
SCHEMBL5552122 0.71 ALDH1A1 (0.37) CYP1A2MAPK1KCNN4CYP2C19ALDH1A1
SCHEMBL2105131 0.69 KCNN4 (0.40) TSHRCYP1A2MAPK1KCNN4CYP2D6
SCHEMBL2105262 0.69 NR3C2 (0.35) TSHRMAPK1KCNN4CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2369670-B1 Non-aqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same UBE INDUSTRIES (JP) 2016-03-23 EP disclosed
US-8722255-B2 Non-aqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same UBE INDUSTRIES, LTD. (JP) 2014-05-13 US disclosed
US-8530080-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2013-09-10 US disclosed
US-8440349-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2013-05-14 US disclosed
EP-1772924-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY UBE INDUSTRIES (JP) 2013-04-10 EP disclosed
US-20130052541-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES, LTD. (JP) 2013-02-28 US disclosed
US-20120183864-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING THE SAME UBE INDUSTRIES, LTD. (JP) 2012-07-19 US disclosed
US-8163427-B2 Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same UBE INDUSTRIES, LTD. (JP) 2012-04-24 US disclosed
EP-2369670-A1 Non-aqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same Ube Industries, Ltd. (JP) 2011-09-28 EP disclosed
US-20100239919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES, LTD. (JP) 2010-09-23 US disclosed
US-7754380-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2010-07-13 US disclosed
US-7629085-B2 sulfur-containing acid ester and an alkyne-containing compound; excellent battery characteristics in cycle performance, electric capacity and storage property; e.g. 2-propynyl methyl carbonate and 1,3-propanesultone UBE INDUSTRIES, LTD. (JP) 2009-12-08 US disclosed
CN-100559648-C Nonaqueous electrolytic solution and the lithium secondary battery that uses it UBE INDUSTRIES (JP) 2009-11-11 CN disclosed
US-20090053598-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MU IONIC SOLUTIONS CORPORATION (JP) 2009-02-26 US disclosed
CN-101107745-A Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES (JP) 2008-01-16 CN disclosed
US-20070231707-A1 Nonaqueous Electrolytic Solution and Lithium Secondary Battery MU IONIC SOLUTIONS CORPORATION (JP) 2007-10-04 US disclosed
EP-1772924-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY Ube Industries, Ltd. (JP) 2007-04-11 EP disclosed
US-20060177742-A1 Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same MU IONIC SOLUTIONS CORPORATION (JP) 2006-08-10 US disclosed
EP-1650826-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-04-26 EP disclosed