SCHEMBL9737463

SCHEMBL9737463

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGD P52209 4/20 0.42
PGK1 P00558 1/20 0.41
PGK2 P07205 1/20 0.41
MPI P34949 1/20 0.35
LPAR5 Q9H1C0 2/20 0.33
LPAR6 P43657 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR4 Q99677 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
ENPP2 Q13822 1/20 0.33
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
PTPN1 P18031 1/20 0.31

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
SCHEMBL9738891 1.00 PGD (0.42) PGDPGK1PGK2MPILPAR5
SCHEMBL9739404 1.00 PGD (0.42) PGDPGK1PGK2MPILPAR5
SCHEMBL9736618 1.00 PGD (0.42) PGDPGK1PGK2MPILPAR5
SCHEMBL372294 0.88 PGD (0.46) PGDPGK1PGK2MPILPAR5
SCHEMBL4959398 0.85 PGD (0.43) PGDPGK1PGK2MPILPAR5
SCHEMBL9736405 0.85 PGD (0.43) PGDPGK1PGK2MPILPAR5
SCHEMBL37330 0.85 PGD (0.43) PGDPGK1PGK2MPILPAR5
SCHEMBL1526127 0.84 PGD (0.42) PGDPGK1PGK2MPILPAR5
SCHEMBL9577688 0.80 PGK1 (0.43) PGDPGK1PGK2MPILPAR5
SCHEMBL9577648 0.80 PGK1 (0.43) PGDPGK1PGK2MPILPAR5

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