SCHEMBL10599366

SCHEMBL10599366

CNCCCCCCCCCCOP(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.61
LPAR2 Q9HBW0 7/20 0.61
LPAR1 Q92633 5/20 0.61
S1PR2 O95136 6/20 0.41
S1PR1 P21453 6/20 0.41
S1PR3 Q99500 6/20 0.41
S1PR4 O95977 5/20 0.41
S1PR5 Q9H228 2/20 0.41
EPHX1 P07099 1/20 0.39
ENPP2 Q13822 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39

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
SCHEMBL17754006 0.91 LPAR3 (0.54) LPAR3LPAR2LPAR1ENPP2
SCHEMBL12563992 0.86 SAT1 (0.53) LPAR3LPAR2LPAR1S1PR2S1PR1
SCHEMBL12563997 0.83 SAT1 (0.55) LPAR3LPAR2LPAR1S1PR2S1PR1
SCHEMBL14005213 0.82 LPAR3 (0.41) LPAR3LPAR2LPAR1S1PR2S1PR1
SCHEMBL12563996 0.82 LPAR3 (0.41) LPAR3LPAR2LPAR1S1PR2S1PR1
SCHEMBL637889 0.82
SCHEMBL6033633 0.82 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL9233772 0.82 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL6851142 0.82 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5
SCHEMBL27042238 0.82 LPAR3 (0.76) LPAR3LPAR2LPAR1LPAR5

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
EP-0225129-B1 PHOSPHOLIPID DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1989-05-24 EP claimed