SCHEMBL504260

SCHEMBL504260

CCCCCCCCCCC(=O)OP(=O)(O)OCC

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.49
LPAR3 Q9UBY5 5/20 0.49
LPAR1 Q92633 4/20 0.49
LPAR6 P43657 1/20 0.49
LPAR4 Q99677 1/20 0.49
LPAR5 Q9H1C0 1/20 0.49
LPAR2 Q9HBW0 1/20 0.49
DGKA P23743 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 2/20 0.46
PAM P19021 2/20 0.44

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
SCHEMBL11576044 1.00 ENPP2 (0.49) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL503670 1.00 ENPP2 (0.49) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL27719763 0.98 ENPP2 (0.46) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL340006 0.91 LPAR1 (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL10703309 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL3924198 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL18409606 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL5146983 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL3422445 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4
SCHEMBL28048302 0.89 DGKA (0.55) ENPP2LPAR3LPAR1LPAR6LPAR4

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-20120028033-A1 PHASE-SEPARATED STRUCTURE AND PRODUCTION METHOD THEREFOR TOHOKU UNIVERSITY (JP) 2012-02-02 US disclosed