SCHEMBL7698286

SCHEMBL7698286

CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC

nearest known ligand 0.85

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 8/20 0.85
ENPP2 Q13822 8/20 0.85
LPAR3 Q9UBY5 5/20 0.85
SMN1; SMN2 Q16637 1/20 0.85
S1PR1 P21453 1/20 0.75
LPAR4 Q99677 2/20 0.74
LPAR5 Q9H1C0 2/20 0.74
LPAR2 Q9HBW0 2/20 0.74
CES2 O00748 1/20 0.74
LPAR6 P43657 1/20 0.74
TRPV1 Q8NER1 1/20 0.74
PRKCE Q02156 1/20 0.71
PRKCQ Q04759 1/20 0.71
PRKCD Q05655 1/20 0.71
PRKCA P17252 1/20 0.71
SELP P16109 1/20 0.70

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
SCHEMBL30555867 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL3817083 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL235478 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL7700077 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL173282 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL15328013 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL15328011 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL200646 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL17549876 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1
SCHEMBL30555910 1.00 LPAR1 (0.85) LPAR1ENPP2LPAR3SMN1; SMN2S1PR1

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
US-6344576-B1 CATIONIC PHOSPHATIDES AND GLYCERIDES MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2002-02-05 US disclosed