SCHEMBL5488321

SCHEMBL5488321

CCP(=O)(O)CC.CCP(=O)(O)CC.CCP(=O)(O)CC.OCCC(O)CO

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.56
GABBR2 O75899 2/20 0.34
GABBR1 Q9UBS5 2/20 0.34
FDPS P14324 3/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PTPN1 P18031 1/20 0.31
PPARD Q03181 1/20 0.30
GABRR1 P24046 1/20 0.30

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
Glycerin SCHEMBL5490443 0.86 LMNA (0.47) THRBGABBR2GABBR1FDPSLMNA
SCHEMBL5488688 0.84 THRB (0.65) THRBGABBR2GABBR1FDPSLMNA
Phosphoric Acid SCHEMBL10535582 0.84 THRB (0.72) THRBGABBR2GABBR1LMNAALDH1A1
SCHEMBL5494733 0.83 THRB (0.52) THRBGABBR2GABBR1FDPSLMNA
SCHEMBL5491017 0.82 GABBR2 (0.37) THRBGABBR2GABBR1FDPSLMNA
SCHEMBL5484506 0.80 GABBR2 (0.50) THRBGABBR2GABBR1FDPSPTPN1
1,3-Butanediol SCHEMBL5493726 0.80 GABBR2 (0.35) GABBR2GABBR1FDPSALDH1A1PTPN1
SCHEMBL5489137 0.79 THRB (0.52) THRBGABBR2GABBR1LMNAALDH1A1
SCHEMBL5488154 0.78 THRB (0.56) THRBGABBR2GABBR1LMNAALDH1A1
Alcohol SCHEMBL21623931 0.78 THRB (0.81) THRBLMNAALDH1A1

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