SCHEMBL5491017

SCHEMBL5491017

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

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 2/20 0.37
GABBR1 Q9UBS5 2/20 0.37
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LAP3 P28838 1/20 0.36
GABRR1 P24046 1/20 0.32
MMP1 P03956 2/20 0.31
MMP2 P08253 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP8 P22894 1/20 0.31
CA9 Q16790 1/20 0.31
FDPS P14324 2/20 0.31
THRB P10828 1/20 0.31
MMP3 P08254 1/20 0.30
SMN1; SMN2 Q16637 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 0.90 LMNA (0.47) GABBR2GABBR1LMNAALDH1A1LAP3
SCHEMBL5484335 0.85 LMNA (0.40) GABBR2GABBR1LMNAALDH1A1LAP3
SCHEMBL28920070 0.85 LMNA (0.40) GABBR2GABBR1LMNAALDH1A1LAP3
SCHEMBL28920065 0.83 LMNA (0.38) GABBR2GABBR1LMNAALDH1A1LAP3
SCHEMBL5488321 0.82 THRB (0.56) GABBR2GABBR1LMNAALDH1A1GABRR1
SCHEMBL5488250 0.82 GABBR2 (0.38) GABBR2GABBR1LMNAALDH1A1LAP3
SCHEMBL5490426 0.80 GABRR1 (0.33) GABBR2GABBR1LMNAALDH1A1LAP3
E968 SCHEMBL5490881 0.80 GABBR2 (0.39) GABBR2GABBR1LMNALAP3MMP2
Propylene Glycol SCHEMBL5488574 0.80 TDP1 (0.53) GABBR2GABBR1ALDH1A1LAP3MMP1
SCHEMBL5492138 0.79 LMNA (0.35) GABBR2GABBR1LMNAALDH1A1LAP3

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