SCHEMBL3765972

SCHEMBL3765972

CCCCCCCC/C=C\CCCCCCCC(=O)OC(=O)COCC(O)CO

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.70
FAAH O00519 2/20 0.60
KDM4E B2RXH2 1/20 0.56
DUSP3 P51452 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LMNA P02545 1/20 0.56
PRKCA P17252 2/20 0.53
PRKCE Q02156 1/20 0.53
PRKCQ Q04759 1/20 0.53
PRKCD Q05655 1/20 0.53
LPAR1 Q92633 6/20 0.50
LPAR4 Q99677 3/20 0.50
LPAR2 Q9HBW0 3/20 0.50
LPAR3 Q9UBY5 3/20 0.50
ENPP2 Q13822 2/20 0.50
LPAR5 Q9H1C0 2/20 0.50
SELP P16109 1/20 0.50
CES2 O00748 1/20 0.50
LPAR6 P43657 1/20 0.50

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
SCHEMBL5245541 0.92 DGKA (0.60) DGKAFAAHKDM4EDUSP3MEN1
SCHEMBL16892660 0.92 LMNA (0.65) DGKAFAAHKDM4EDUSP3MEN1
SCHEMBL3166259 0.92 LMNA (0.65) DGKAFAAHKDM4EDUSP3MEN1
Glycerin SCHEMBL27499447 0.88 DGKA (0.74) DGKAFAAHKDM4EDUSP3MEN1
Glycerin SCHEMBL3120673 0.88 DGKA (0.74) DGKAFAAHKDM4EDUSP3MEN1
Dodecanoate SCHEMBL28255070 0.87 MEN1 (0.58) DGKAKDM4EDUSP3MEN1KMT2A
SCHEMBL5182737 0.86 DGKA (0.90) DGKAFAAHKDM4EDUSP3MEN1
SCHEMBL18067435 0.83 DGKA (0.90) DGKAFAAHKDM4EDUSP3MEN1
SCHEMBL28512549 0.83 DGKA (0.90) DGKAFAAHKDM4EDUSP3MEN1
SCHEMBL18970879 0.82 DGKA (1.00) DGKAFAAHKDM4EDUSP3MEN1

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
US-20100317784-A1 INORGANIC POWDER-CONTAINING RESIN COMPOSITION, AND A SUBSTRATE HAVING A DIELECTRIC LAYER FORMED THEREON NITTO DENKO CORPORATION (JP) 2010-12-16 US disclosed
US-5891375-A Processes for precipitating tertiary amine oxide cellulose solutions containing esters and products made therefrom ALFACEL S.A. (ES) 1999-04-06 US disclosed