SCHEMBL1471722

SCHEMBL1471722

CCCCOCCOC(C)COC(=O)OCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.38
MAPT P10636 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 4/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
PLA2G2C Q5R387 1/20 0.35
EPHX2 P34913 1/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
RARB P10826 1/20 0.33
NAAA Q02083 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
SCHEMBL1470183 0.92 TSHR (0.40) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1471733 0.92 ALDH1A1 (0.39) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1470025 0.92 ALDH1A1 (0.41) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1469572 0.91 CYP3A4 (0.38) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1469907 0.90 MAPT (0.43) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1469323 0.90 ALDH1A1 (0.45) ALDH1A1ATMMAPTTSHRCYP3A4
SCHEMBL1470238 0.87 ALDH1A1 (0.40) ALDH1A1ATMMAPTHSD17B10TSHR
SCHEMBL1469971 0.86 NAAA (0.41) ALDH1A1MAPTTSHRPLA2G2CHCAR2
SCHEMBL1470227 0.86 ALDH1A1 (0.43) ALDH1A1ATMMAPTTSHRCYP3A4
SCHEMBL1469634 0.85 NAAA (0.46) ALDH1A1ATMMAPTTSHRHCAR2

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 7 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-8435681-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2013-05-07 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