SCHEMBL4748865

SCHEMBL4748865

CCCCCCCC/C=C\CCCCCCCCO[C@H](COCc1ccccc1)COC(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.53
CNR2 P34972 1/20 0.53
PRKCE Q02156 1/20 0.53
PRKCQ Q04759 1/20 0.53
PRKCD Q05655 1/20 0.53
PRKCA P17252 1/20 0.53
LPAR1 Q92633 2/20 0.49
ENPP2 Q13822 2/20 0.49
DGKA P23743 1/20 0.49
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
LPAR3 Q9UBY5 1/20 0.48
FAAH O00519 1/20 0.47
EPHX2 P34913 1/20 0.47
TBXAS1 P24557 2/20 0.46

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
SCHEMBL13058704 0.94 TBXAS1 (0.50) PRKCEPRKCQPRKCDPRKCATBXAS1
SCHEMBL3757478 0.94 TBXAS1 (0.50) PRKCEPRKCQPRKCDPRKCATBXAS1
SCHEMBL25876610 0.87 CNR1 (0.46) CNR1CNR2FAAHEPHX2
SCHEMBL9138272 0.85 PLA2G10 (0.50) CNR1CNR2LPAR1LPAR3
SCHEMBL3422790 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD
SCHEMBL9456740 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD
SCHEMBL2199246 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD
SCHEMBL7768145 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD
SCHEMBL7754260 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD
SCHEMBL3422781 0.85 PRKCA (0.69) CNR1CNR2PRKCEPRKCQPRKCD

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
WO-2008124729-A1 ONE-POT SYNTHESIS OF ALPHA/BETA-O-GLYCOLIPIDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-10-16 WO disclosed