SCHEMBL4267679

SCHEMBL4267679

CCCCOP(=O)(O)C(C)(C(=O)O)P(=O)(O)OCCCC

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.47
LPAR3 Q9UBY5 8/20 0.46
LPAR2 Q9HBW0 6/20 0.46
LPAR1 Q92633 3/20 0.46
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.36
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35

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
SCHEMBL787793 0.87 CYP3A4 (0.48) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL814225 0.83 CYP3A4 (0.48) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL2350302 0.81 CYP3A4 (0.42) CYP3A4LPAR3LPAR2LPAR1ALDH1A1
SCHEMBL4119345 0.80 LPAR3 (0.48) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL5028839 0.79 CYP3A4 (0.44) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL5028805 0.76 CYP3A4 (0.41) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8055462 0.76 CYP3A4 (0.48) CYP3A4LPAR3LPAR2LPAR1
SCHEMBL2353087 0.75 LPAR3 (0.51) LPAR3LPAR2LPAR1
SCHEMBL2354207 0.75 LPAR3 (0.51) LPAR3LPAR2LPAR1
SCHEMBL2351070 0.75 LPAR3 (0.51) LPAR3LPAR2LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2006331-B1 POLYLACTIC ACID COMPOSITION TEIJIN LTD (JP) 2014-10-15 EP disclosed
EP-2006331-A9 POLYLACTIC ACID COMPOSITION Teijin Limited (JP) 2009-07-29 EP disclosed
EP-2006331-A2 POLYLACTIC ACID COMPOSITION Teijin Limited (JP) 2008-12-24 EP disclosed