SCHEMBL1470085

SCHEMBL1470085

CCCCOC(C)(C)OC(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
SOAT1 P35610 1/20 0.40
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
ATM Q13315 2/20 0.38
TSHR P16473 3/20 0.36
HPGD P15428 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
HCAR2 Q8TDS4 1/20 0.34
ESR1 P03372 2/20 0.33
NAAA Q02083 1/20 0.33
DGKA P23743 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPK1 P28482 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL1470045 0.91 ALDH1A1 (0.47) ALDH1A1ATMTSHRHPGDL3MBTL1
SCHEMBL1469628 0.88 ALDH1A1 (0.41) ALDH1A1CYP4F2CYP4A11ATMTSHR
SCHEMBL1470096 0.86 NAAA (0.47) ALDH1A1ATMTSHRHCAR2NAAA
SCHEMBL1471638 0.85 ALDH1A1 (0.45) ALDH1A1ATMTSHRHPGDL3MBTL1
SCHEMBL1469392 0.83 CA1 (0.40) ALDH1A1ATMTSHRHPGDMAPT
SCHEMBL28132615 0.82 ALDH1A1 (0.40) ALDH1A1SOAT1CYP4F2CYP4A11ATM
SCHEMBL1469363 0.82 ALDH1A1 (0.52) ALDH1A1SOAT1CYP4F2CYP4A11TSHR
SCHEMBL1469833 0.79 NAAA (0.47) ALDH1A1TSHRHCAR2NAAADGKA
SCHEMBL11129740 0.79 ALDH1A1 (0.40) ALDH1A1CYP4F2CYP4A11ATMTSHR
SCHEMBL5484696 0.79 ALDH1A1 (0.40) ALDH1A1ATMTSHRHPGDL3MBTL1

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