SCHEMBL2992408

SCHEMBL2992408

CCCOP(=O)(CCCC(C)=O)OCCC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.36
CYP3A4 P08684 1/20 0.34
LPAR3 Q9UBY5 3/20 0.34
LPAR1 Q92633 2/20 0.34
LPAR2 Q9HBW0 2/20 0.34
ALDH1A1 P00352 1/20 0.33
ACHE P22303 1/20 0.33
CES2 O00748 1/20 0.33
PAOX Q6QHF9 1/20 0.33

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
SCHEMBL2990566 0.88 PPARD (0.39) PPARDCYP3A4LPAR3LPAR1LPAR2
SCHEMBL28178043 0.85 AKR1B1 (0.45) PPARDALDH1A1
SCHEMBL2990604 0.84 PPARD (0.54) PPARDALDH1A1ACHEPAOX
SCHEMBL15951711 0.81 TSHR (0.48) ALDH1A1
SCHEMBL2687293 0.81 DGKA (0.48) LPAR3LPAR1LPAR2
SCHEMBL2356490 0.80 CYP1A2 (0.47) PPARDCYP3A4LPAR3LPAR1LPAR2
SCHEMBL779020 0.79 CYP3A4 (0.48) PPARDCYP3A4LPAR3LPAR1LPAR2
SCHEMBL15951960 0.79 DGKA (0.50) LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL29169497 0.78 PPARD (0.52) PPARDPAOX
SCHEMBL4451725 0.76 PPARD (0.48) PPARDCYP3A4LPAR3LPAR1LPAR2

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-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed