SCHEMBL5484506

SCHEMBL5484506

CCCCP(=O)(O)CCCC.CCCCP(=O)(O)CCCC.CCCCP(=O)(O)CCCC.OCCC(O)CO

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.50
GABRR1 P24046 1/20 0.50
GABBR1 Q9UBS5 1/20 0.50
THRB P10828 1/20 0.48
FDPS P14324 5/20 0.39
PTPN1 P18031 1/20 0.37
LPAR3 Q9UBY5 3/20 0.36
LPAR2 Q9HBW0 1/20 0.36
LAP3 P28838 1/20 0.36
S1PR2 O95136 3/20 0.36
S1PR1 P21453 3/20 0.36
S1PR3 Q99500 3/20 0.36
S1PR4 O95977 2/20 0.36

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
SCHEMBL5494733 0.89 THRB (0.52) GABBR2GABRR1GABBR1THRBFDPS
Glycerin SCHEMBL5487457 0.88 GABBR2 (0.57) GABBR2GABRR1GABBR1FDPSLPAR3
SCHEMBL5482004 0.85 GABBR2 (0.53) GABBR2GABRR1GABBR1FDPSLPAR3
1,3-Butanediol SCHEMBL5484496 0.83 GABBR2 (0.52) GABBR2GABRR1GABBR1FDPSPTPN1
SCHEMBL5488321 0.80 THRB (0.56) GABBR2GABRR1GABBR1THRBFDPS
E968 SCHEMBL5488331 0.80 GABBR2 (0.57) GABBR2GABRR1GABBR1FDPSLPAR3
Propylene Glycol SCHEMBL5485706 0.80 GABBR2 (0.57) GABBR2GABRR1GABBR1FDPSLPAR3
Ethylene Glycol SCHEMBL5491034 0.80 GABBR2 (0.67) GABBR2GABRR1GABBR1FDPSLPAR3
Phosphoric Acid SCHEMBL27425876 0.78 FDPS (0.52) THRBFDPSLAP3
1,3-Propanediol SCHEMBL5485229 0.78 GABBR2 (0.64) GABBR2GABRR1GABBR1FDPSLPAR3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070087270-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-04-19 US disclosed
US-7169511-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte solution secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-30 US disclosed
EP-1555711-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY CONTAINING THE SAME Mitsubishi Chemical Corporation (JP) 2005-07-20 EP disclosed
US-20050014071-A1 Nonaqueous electrolyte solution and nonaqueous electrolyte solution secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-01-20 US disclosed