SCHEMBL1469745

SCHEMBL1469745

CCCCCCCCCCCC1OCC2(CO1)COC(CCCCCCCCCCC)OC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
EPHX1 P07099 1/20 0.47
TDP1 Q9NUW8 1/20 0.38
SPHK1 Q9NYA1 4/20 0.38
SPHK2 Q9NRA0 3/20 0.38
PRKD3 O94806 2/20 0.37
PRKCG P05129 2/20 0.37
PRKCB P05771 2/20 0.37
PRKCA P17252 2/20 0.37
PRKCH P24723 2/20 0.37
PRKCI P41743 2/20 0.37
PRKCE Q02156 2/20 0.37
PRKCQ Q04759 2/20 0.37
PRKCZ Q05513 2/20 0.37
PRKCD Q05655 2/20 0.37
PRKD1 Q15139 2/20 0.37
ENPP2 Q13822 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
CYP1A2 P05177 2/20 0.35
TSHR P16473 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
SCHEMBL1471935 1.00 ALDH1A1 (0.56) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL1470343 1.00 ALDH1A1 (0.56) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL1470315 1.00 ALDH1A1 (0.56) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL13412536 1.00 ALDH1A1 (0.56) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL10135449 0.91 ALDH1A1 (0.43) ALDH1A1EPHX1TDP1CYP1A2
SCHEMBL11219791 0.85 ALDH1A1 (0.54) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL20732767 0.85 ALDH1A1 (0.54) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL22919267 0.85 ALDH1A1 (0.39) ALDH1A1EPHX1CYP1A2
SCHEMBL256016 0.83 ALDH1A1 (0.50) ALDH1A1EPHX1TDP1SPHK1SPHK2
SCHEMBL13682862 0.82 ALDH1A1 (0.36) ALDH1A1EPHX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3249735-A2 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING THE SAME Mitsubishi Chemical Corporation (JP) 2017-11-29 EP disclosed
US-9231274-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-05 US disclosed
US-9136560-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2015-09-15 US disclosed
US-20130196225-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-01 US disclosed
US-8435681-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2013-05-07 US disclosed
US-20130095379-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME KOTATO MINORU (JP) 2013-04-18 US disclosed
US-20120244426-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-09-27 US disclosed
US-8043745-B2 Non-aqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2011-10-25 US disclosed
US-8007938-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-30 US disclosed
US-20110070485-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2011-03-24 US disclosed
US-20070224514-A1 Nonaqueous Electrolyte Solution and Lithium Secondary Battery Using Same MITSUBISHI CHEMICAL CORPORATION (JP) 2007-09-27 US disclosed
EP-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed