SCHEMBL1469307

SCHEMBL1469307

CCCCOCC(C)OC(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
PLA2G2C Q5R387 7/20 0.40
SOAT1 P35610 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
HSD17B10 Q99714 2/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
USP2 O75604 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 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
SCHEMBL1469912 0.91 ALDH1A1 (0.44) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL1470241 0.89 PLA2G2C (0.44) ALDH1A1PLA2G2CTDP1HSD17B10USP2
SCHEMBL31341045 0.88 PLA2G2C (0.39) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL12262535 0.87 MAPT (0.46) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL1469952 0.87 PLA2G2C (0.48) PLA2G2CUSP2SPHK1TSHRHTT
Bromide SCHEMBL31022724 0.87 PLA2G2C (0.38) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL1471648 0.86 ALDH1A1 (0.42) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL1470049 0.86 PLA2G2C (0.45) ALDH1A1PLA2G2CTDP1HSD17B10MAPT
SCHEMBL1469782 0.83 ALDH1A1 (0.48) ALDH1A1SOAT1TDP1HSD17B10TSHR
SCHEMBL1470040 0.83 ALDH1A1 (0.40) ALDH1A1PLA2G2CSOAT1ATMUSP2

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 8 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-9136560-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2015-09-15 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-20110070485-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2011-03-24 US disclosed
EP-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed