SCHEMBL1471805

SCHEMBL1471805

CCCCOC(=O)OCCOCC(CC)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
AKT1 P31749 3/20 0.40
AKT2 P31751 3/20 0.40
AKT3 Q9Y243 3/20 0.40
LPAR6 P43657 4/20 0.40
LPAR1 Q92633 4/20 0.40
LPAR4 Q99677 4/20 0.40
LPAR5 Q9H1C0 4/20 0.40
LPAR2 Q9HBW0 4/20 0.40
LPAR3 Q9UBY5 4/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
PIK3R1 P27986 1/20 0.39
PIK3CA P42336 1/20 0.39
ATM Q13315 1/20 0.39
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCH P24723 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
SCHEMBL1469781 0.94 LPAR1 (0.48) AKT1AKT2AKT3LPAR6LPAR1
SCHEMBL1470277 0.93 LPAR1 (0.43) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL5480708 0.93 AKT1 (0.37) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1469817 0.90 ALDH1A1 (0.44) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1470275 0.89 TSHR (0.41) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1469910 0.89 TSHR (0.41) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1470246 0.88 AKT1 (0.35) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1470161 0.88 ALDH1A1 (0.46) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1470229 0.88 ALDH1A1 (0.45) ALDH1A1AKT1AKT2AKT3LPAR6
SCHEMBL1469693 0.88 CA1 (0.39) ALDH1A1AKT1AKT2AKT3LPAR6

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