SCHEMBL9737452

SCHEMBL9737452

O=C(COP(=O)(O)O)[C@H](O)[C@@H](O)COP(=O)(O)O

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGD P52209 3/20 0.66
MPI P34949 1/20 0.50
PGK1 P00558 1/20 0.48
PGK2 P07205 1/20 0.48
TPI1 P60174 2/20 0.41
LPAR5 Q9H1C0 2/20 0.35
LPAR6 P43657 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR4 Q99677 1/20 0.35
LPAR2 Q9HBW0 1/20 0.35
LPAR3 Q9UBY5 1/20 0.35
ENPP2 Q13822 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
SCHEMBL9737349 1.00 PGD (0.66) PGDMPIPGK1PGK2TPI1
SCHEMBL19717630 1.00 PGD (0.66) PGDMPIPGK1PGK2TPI1
SCHEMBL26828 1.00 PGD (0.66) PGDMPIPGK1PGK2TPI1
SCHEMBL9738243 1.00 PGD (0.66) PGDMPIPGK1PGK2TPI1
Water SCHEMBL17651169 0.98 PGD (0.63) PGDMPIPGK1PGK2TPI1
SCHEMBL15039691 0.89 PGD (0.56) PGDMPIPGK1PGK2TPI1
SCHEMBL328998 0.89 PGD (0.56) PGDMPIPGK1PGK2TPI1
SCHEMBL9737138 0.89 PGD (0.56) PGDMPIPGK1PGK2TPI1
SCHEMBL9737177 0.89 PGD (0.56) PGDMPIPGK1PGK2TPI1
SCHEMBL9738023 0.89 PGD (0.56) PGDMPIPGK1PGK2TPI1

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-0506772-A1 A PHARMACEUTICAL COMPOSITION COMPRISING A PHOSPHOSUGAR PERSTORP AB (SE) 1992-10-07 EP disclosed
WO-1991009604-A1 A PHARMACEUTICAL COMPOSITION COMPRISING A PHOSPHOSUGAR PERSTORP AB (SE) 1991-07-11 WO disclosed