SCHEMBL1401583

SCHEMBL1401583

C#CCOC(=O)C(=O)OCC#C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
TSHR P16473 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
POLB P06746 1/20 0.38
GSTP1 P09211 1/20 0.38
RECQL P46063 1/20 0.37
CYP1A2 P05177 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
NFKB1 P19838 1/20 0.35

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
SCHEMBL2106112 0.87 NPC1 (0.41) NPC1SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL2106400 0.87 ALDH1A1 (0.43) NPC1TSHRPOLBALDH1A1L3MBTL1
SCHEMBL10324052 0.86
SCHEMBL4676324 0.84
SCHEMBL3627408 0.84
SCHEMBL11341106 0.84
SCHEMBL16864190 0.83 NPC1 (0.38) NPC1SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL12459393 0.82 NPC1 (0.37) NPC1SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL14053080 0.82 NPC1 (0.37) NPC1SLC1A3SLC1A2SLC1A1TSHR
SCHEMBL17264973 0.82 NPC1 (0.37) NPC1SLC1A3SLC1A2SLC1A1TSHR

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 430 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110066292-B Method for preparing unsaturated propyl phosphite ester and phosphate ester 江苏长园华盛新能源材料有限公司 2022-02-15 CN claimed
EP-3305753-B1 LITHIUM SALT COMPOUND, NONAQUEOUS ELECTROLYTE SOLUTION USING SAME, LITHIUM ION SECONDARY BATTERY AND LITHIUM ION CAPACITOR UBE INDUSTRIES (JP) 2020-08-19 EP claimed
US-10446871-B2 Lithium salt compound, nonaqueous electrolyte solution using same, lithium ion secondary battery and lithium ion capacitor UBE INDUSTRIES, LTD. (JP) 2019-10-15 US claimed
US-20180159173-A1 LITHIUM SALT COMPOUND, NONAQUEOUS ELECTROLYTE SOLUTION USING SAME, LITHIUM ION SECONDARY BATTERY AND LITHIUM ION CAPACITOR UBE INDUSTRIES, LTD. (JP) 2018-06-07 US claimed
EP-2704246-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION, ELECTRICAL STORAGE DEVICE UTILIZING SAME, AND CYCLIC SULFONIC ACID ESTER COMPOUND UBE INDUSTRIES (JP) 2017-08-23 EP claimed
US-9608287-B2 Non-aqueous electrolytic solution, electrical storage device utilizing same, and cyclic sulfonic acid ester compound UBE INDUSTRIES, LTD. (JP) 2017-03-28 US claimed
EP-2698859-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICITY-STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2016-07-27 EP claimed
EP-3041078-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR ELECTRICITY STORAGE DEVICES UBE Industries, Ltd. (JP) 2016-07-06 EP claimed
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US claimed
US-20160181672-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR ENERGY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2016-06-23 US claimed
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 claimed
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 claimed
US-20100239919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES, LTD. (JP) 2010-09-23 US claimed
US-7794876-B2 Pentafluorophenyloxy compound, and nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2010-09-14 US claimed
US-7754380-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2010-07-13 US claimed
CN-100446335-C Nonaqueous electrolyte secondary battery SANYO ELECTRIC CO (JP) 2008-12-24 CN claimed
US-20070178380-A1 Nonaqueous solvent mixture containing vinylene carbonate and di92-propynyl) oxalate SANYO ELECTRIC CO., LTD. (JP) 2007-08-02 US claimed
CN-1890836-A Nonaqueous electrolyte secondary battery SANYO ELECTRIC CO (JP) 2007-01-03 CN claimed
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 claimed
EP-1650826-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-04-26 EP claimed