SCHEMBL5488688

SCHEMBL5488688

CP(C)(=O)O.CP(C)(=O)O.CP(C)(=O)O.OCCC(O)CO

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.65
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
GABBR2 O75899 2/20 0.38
GABBR1 Q9UBS5 2/20 0.38
GABRR1 P24046 1/20 0.38
CA2 P00918 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
FDPS P14324 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
PTPN1 P18031 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
Phosphoric Acid SCHEMBL10535582 0.90 THRB (0.72) THRBALDH1A1LMNAGABBR2GABBR1
SCHEMBL5488321 0.84 THRB (0.56) THRBALDH1A1LMNAGABBR2GABBR1
SCHEMBL5488154 0.84 THRB (0.56) THRBALDH1A1LMNAGABBR2GABBR1
Glycerin SCHEMBL5488218 0.84 LMNA (0.56) THRBALDH1A1LMNAGABBR2GABBR1
SCHEMBL5490927 0.82 THRB (0.54) THRBALDH1A1LMNA
Ethane SCHEMBL940430 0.81
SCHEMBL29798 0.81
SCHEMBL705919 0.81
SCHEMBL709962 0.81
SCHEMBL5489137 0.81 THRB (0.52) THRBALDH1A1LMNAGABBR2GABBR1

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