SCHEMBL8776459

SCHEMBL8776459

CCCCCCCC/C=C\CCCCCCCCCCCCC(O)C(O)COP(=O)(O)O

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 2/20 0.59
S1PR1 P21453 2/20 0.59
S1PR3 Q99500 2/20 0.59
S1PR5 Q9H228 2/20 0.59
S1PR2 O95136 1/20 0.59
ALDH1A1 P00352 1/20 0.59
TSPO P30536 1/20 0.59
TMEM97 Q5BJF2 1/20 0.59
SIGMAR1 Q99720 1/20 0.59
LPAR1 Q92633 7/20 0.59
LPAR3 Q9UBY5 5/20 0.59
LPAR2 Q9HBW0 3/20 0.59
ENPP2 Q13822 3/20 0.59
LPAR4 Q99677 2/20 0.59
LPAR5 Q9H1C0 2/20 0.59
CES2 O00748 1/20 0.59
LPAR6 P43657 1/20 0.59
TRPV1 Q8NER1 1/20 0.59
SGPL1 O95470 8/20 0.57

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
SCHEMBL13030814 0.91 SGPL1 (0.66) LPAR1LPAR3LPAR2ENPP2LPAR4
SCHEMBL8934971 0.91 SGPL1 (0.66) LPAR1LPAR3LPAR2ENPP2LPAR4
SCHEMBL861987 0.89 SGPL1 (0.63) LPAR1LPAR3LPAR2ENPP2LPAR4
SCHEMBL1273298 0.89 SGPL1 (0.63) LPAR1LPAR3LPAR2ENPP2LPAR4
SCHEMBL4661532 0.86 S1PR4 (0.54) S1PR4S1PR1S1PR3S1PR5S1PR2
SCHEMBL5500454 0.82 S1PR4 (0.75) S1PR4S1PR1S1PR3S1PR5S1PR2
SCHEMBL13030815 0.82 S1PR4 (0.75) S1PR4S1PR1S1PR3S1PR5S1PR2
SCHEMBL16636672 0.81 LPAR1 (0.64) S1PR4S1PR1S1PR3S1PR5S1PR2
SCHEMBL16395496 0.81 LPAR1 (0.64) S1PR4S1PR1S1PR3S1PR5S1PR2
SCHEMBL12766772 0.81 LPAR1 (0.64) S1PR4S1PR1S1PR3S1PR5S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0808368-A1 DNA SEQUENCE ENCODING PLANT 2-ACYLTRANSFERASE Gene Shears Pty Limited (AU) 1997-11-26 EP disclosed
WO-1996024674-A1 DNA SEQUENCE ENCODING PLANT 2-ACYLTRANSFERASE GENE SHEARS PTY. LIMITED (AU) 1996-08-15 WO disclosed