SCHEMBL8726630

SCHEMBL8726630

CCCC(C)OCC(O)COP(=O)(O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR5 Q9H1C0 4/20 0.51
LPAR1 Q92633 9/20 0.48
LPAR3 Q9UBY5 5/20 0.48
LPAR4 Q99677 3/20 0.48
LPAR2 Q9HBW0 3/20 0.48
ENPP2 Q13822 3/20 0.48
LPAR6 P43657 2/20 0.48
CES2 O00748 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
SGPL1 O95470 4/20 0.39
PGK1 P00558 1/20 0.39
PGK2 P07205 1/20 0.39
MPI P34949 1/20 0.37
PGD P52209 1/20 0.37

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
SCHEMBL8723225 1.00 LPAR5 (0.51) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL1834727 0.83 TDP1 (0.43)
SCHEMBL28797228 0.77 TDP1 (0.42)
SCHEMBL1286423 0.77 PGK1 (0.58) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL13894007 0.76 LPAR5 (0.49) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL12766757 0.76 LPAR5 (0.63) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL10238867 0.76 LPAR5 (0.63) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL10280030 0.76 LPAR5 (0.63) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL17585751 0.76 LPAR5 (0.63) LPAR5LPAR1LPAR3LPAR4LPAR2
SCHEMBL10238872 0.76 LPAR5 (0.63) LPAR5LPAR1LPAR3LPAR4LPAR2

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-5827831-A Lipid nucleotide analog prodrugs for oral administration NEXSTAR PHARMACEUTICALS, INC. (US) 1998-10-27 US claimed