SCHEMBL16636672

SCHEMBL16636672

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

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 8/20 0.64
LPAR3 Q9UBY5 5/20 0.64
ENPP2 Q13822 4/20 0.64
LPAR2 Q9HBW0 3/20 0.64
LPAR4 Q99677 2/20 0.64
LPAR5 Q9H1C0 2/20 0.64
CES2 O00748 1/20 0.64
LPAR6 P43657 1/20 0.64
TRPV1 Q8NER1 1/20 0.64
PLA2G4A P47712 4/20 0.60
S1PR1 P21453 3/20 0.56
S1PR4 O95977 2/20 0.54
S1PR3 Q99500 2/20 0.54
S1PR5 Q9H228 2/20 0.54
S1PR2 O95136 1/20 0.54
ALDH1A1 P00352 1/20 0.54
TSPO P30536 1/20 0.54
TMEM97 Q5BJF2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54

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
SCHEMBL16395496 1.00 LPAR1 (0.64) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL8744617 0.92 ENPP2 (0.58) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL7739234 0.92 ENPP2 (0.58) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL6646106 0.86 LPAR1 (0.60) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL18628314 0.84 LPAR1 (0.65) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL28281769 0.84 LPAR1 (0.65) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL4979203 0.84 LPAR1 (0.63) LPAR1LPAR3ENPP2LPAR2LPAR4
Phosphoric Acid SCHEMBL28539599 0.82 FABP3 (0.51)
Alcohol SCHEMBL28250193 0.82 S1PR1 (0.63) LPAR1LPAR3ENPP2LPAR2LPAR4
SCHEMBL8776459 0.81 S1PR4 (0.59) LPAR1LPAR3ENPP2LPAR2LPAR4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3065732-A1 COMPOUNDS, COMPOSITIONS AND USES THEREOF FOR THE PREVENTION AND/OR TREATMENT OF DYSLIPIDEMIA Centre National de la Recherche Scientifique (CNRS) (FR) 2016-09-14 EP claimed
WO-2015052237-A1 COMPOUNDS, COMPOSITIONS AND USES THEREOF FOR THE PREVENTION AND/OR TREATMENT OF DYSLIPIDEMIA CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2015-04-16 WO claimed
EP-3065733-A1 COMPOUNDS AND COMPOSITIONS COMPRISING SUCH COMPOUNDS FOR THE PREVENTION OR TREATMENT OF DYSLIPIDAEMIAS Centre National De La Recherche Scientifique (FR) 2016-09-14 EP disclosed
EP-3065732-A1 COMPOUNDS, COMPOSITIONS AND USES THEREOF FOR THE PREVENTION AND/OR TREATMENT OF DYSLIPIDEMIA Centre National de la Recherche Scientifique (CNRS) (FR) 2016-09-14 EP disclosed
WO-2015052433-A1 COMPOUNDS AND COMPOSITIONS COMPRISING SUCH COMPOUNDS FOR THE PREVENTION OR TREATMENT OF DYSLIPIDAEMIAS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-04-16 WO disclosed
WO-2015052237-A1 COMPOUNDS, COMPOSITIONS AND USES THEREOF FOR THE PREVENTION AND/OR TREATMENT OF DYSLIPIDEMIA CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2015-04-16 WO disclosed