SCHEMBL5489816

SCHEMBL5489816

CCCCOC(CC)COCCCC(CC)OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.42
LPAR3 Q9UBY5 4/20 0.42
TLR2 O60603 12/20 0.40
LPAR2 Q9HBW0 1/20 0.39
PRKCA P17252 1/20 0.37
PRKCD Q05655 1/20 0.37
PLA2G2C Q5R387 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
SCHEMBL5476609 0.89 PRKCA (0.38) LPAR1LPAR3TLR2LPAR2PRKCA
SCHEMBL12544758 0.89 PRKCA (0.41) PRKCAPRKCDPLA2G2C
SCHEMBL5916675 0.85 USP2 (0.39) LPAR1LPAR3TLR2LPAR2PLA2G2C
SCHEMBL5476277 0.82 TSHR (0.41) LPAR1LPAR3TLR2PLA2G2C
SCHEMBL12544472 0.81 LPAR1 (0.44) LPAR1LPAR3TLR2LPAR2PLA2G2C
SCHEMBL5487674 0.81 PRKCA (0.36) LPAR1LPAR3TLR2PRKCAPRKCD
SCHEMBL5480647 0.80 PRKCA (0.36) PRKCAPRKCD
SCHEMBL608475 0.80 PRKCA (0.50) PRKCAPRKCD
SCHEMBL1938849 0.80 LPAR1 (0.49) LPAR1LPAR3TLR2LPAR2PRKCA
SCHEMBL12544461 0.80 LPAR1 (0.42) LPAR1LPAR3TLR2LPAR2PLA2G2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed