SCHEMBL1469998

SCHEMBL1469998

CCCCOC(CC)COCCCOC(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 10/20 0.44
LPAR1 Q92633 4/20 0.43
LPAR3 Q9UBY5 4/20 0.43
LPAR2 Q9HBW0 1/20 0.40
PLA2G2C Q5R387 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ATM Q13315 1/20 0.37
MAPT P10636 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL1469569 0.97 TLR2 (0.47) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1469532 0.92 TLR2 (0.42) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1469944 0.90 LPAR1 (0.43) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1470348 0.89 LPAR1 (0.42) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1470240 0.89 PLA2G2C (0.38) TLR2LPAR1LPAR3PLA2G2CCA1
SCHEMBL1470381 0.87 LPAR1 (0.42) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1470094 0.87 CA1 (0.42) TLR2LPAR1LPAR3ALDH1A1CA1
SCHEMBL1470110 0.86 LPAR1 (0.46) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL12544472 0.86 LPAR1 (0.44) TLR2LPAR1LPAR3LPAR2PLA2G2C
SCHEMBL1470330 0.86 ALDH1A1 (0.40) TLR2LPAR1LPAR3LPAR2PLA2G2C

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