SCHEMBL5701751

SCHEMBL5701751

CCCCCC[C@H](C/C=C\CCCCCCCC(=O)OCCCC)OCC(O)CO

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.65
FAAH O00519 4/20 0.57
PRKCA P17252 2/20 0.54
PRKCE Q02156 1/20 0.54
PRKCQ Q04759 1/20 0.54
PRKCD Q05655 1/20 0.54
KDM4E B2RXH2 1/20 0.53
DUSP3 P51452 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 1/20 0.53
SELP P16109 1/20 0.51
LPAR1 Q92633 5/20 0.48
ENPP2 Q13822 2/20 0.48
LPAR4 Q99677 2/20 0.48
LPAR5 Q9H1C0 2/20 0.48
LPAR2 Q9HBW0 2/20 0.48
LPAR3 Q9UBY5 2/20 0.48
CES2 O00748 1/20 0.48
LPAR6 P43657 1/20 0.48

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
SCHEMBL28540767 0.87 DGKA (0.65) DGKAFAAHPRKCAPRKCEPRKCQ
SCHEMBL28020113 0.87 FFAR1 (0.65) DGKAFAAHDUSP3KMT2ALMNA
SCHEMBL8931485 0.87 FFAR1 (0.65) DGKAFAAHDUSP3KMT2ALMNA
SCHEMBL18674362 0.86 DGKA (0.77) DGKAFAAHPRKCAPRKCEPRKCQ
Glycerin SCHEMBL5701746 0.85 DGKA (0.65) DGKAFAAHPRKCAPRKCEPRKCQ
SCHEMBL4435450 0.85 DGKA (0.69) DGKAFAAHPRKCAPRKCEPRKCQ
SCHEMBL20292485 0.85 DGKA (0.61) DGKAFAAHPRKCAPRKCEPRKCQ
SCHEMBL8781081 0.84 DGKA (0.82) DGKAFAAHPRKCAPRKCEPRKCQ
Glyceryl Monooleate SCHEMBL18000922 0.84 DGKA (0.87) DGKAFAAHPRKCAPRKCEPRKCQ
SCHEMBL14151288 0.84 DGKA (0.82) DGKAFAAHPRKCAPRKCEPRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697452-A1 POLYESTER COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2006-09-06 EP disclosed
WO-2005063868-A1 POLYESTER COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2005-07-14 WO disclosed