SCHEMBL9577648

SCHEMBL9577648

O=P(O)(O)OC[C@@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](COP(=O)(O)O)OP(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.43
PGK2 P07205 1/20 0.43
PGD P52209 5/20 0.41
MPI P34949 1/20 0.41
LPAR5 Q9H1C0 2/20 0.37
LPAR6 P43657 1/20 0.34
LPAR1 Q92633 1/20 0.34
LPAR4 Q99677 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34
LPAR3 Q9UBY5 1/20 0.34
ENPP2 Q13822 1/20 0.34
FBP1 P09467 1/20 0.33

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
SCHEMBL11567749 0.98 PGK1 (0.42) PGK1PGK2PGDMPILPAR5
SCHEMBL9577688 0.95 PGK1 (0.43) PGK1PGK2PGDMPILPAR5
SCHEMBL9577585 0.88 PGK1 (0.48) PGK1PGK2PGDMPILPAR5
SCHEMBL15728251 0.88 PGK1 (0.48) PGK1PGK2PGDMPILPAR5
SCHEMBL899532 0.87 MPI (0.58) PGK1PGK2PGDMPILPAR5
SCHEMBL23064232 0.86 MPI (0.43) PGK1PGK2PGDMPILPAR5
SCHEMBL23064234 0.86 MPI (0.43) PGK1PGK2PGDMPILPAR5
SCHEMBL9737465 0.85 MPI (0.59) PGK1PGK2PGDMPILPAR5
SCHEMBL9736725 0.85 MPI (0.59) PGK1PGK2PGDMPILPAR5
SCHEMBL9736070 0.85 MPI (0.59) PGK1PGK2PGDMPILPAR5

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
WO-1993023054-A1 POLYPHOSPHORYLATED ORGANIC COMPOUNDS: COMPOSITIONS USEFUL IN PROTECTING BIOLOGICAL TISSUES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-11-25 WO claimed
US-5260287-A Phosphorylated alcohols and polyvalent cations used as antiulcer agents BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 1993-11-09 US claimed
WO-1993023054-A1 POLYPHOSPHORYLATED ORGANIC COMPOUNDS: COMPOSITIONS USEFUL IN PROTECTING BIOLOGICAL TISSUES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-11-25 WO disclosed
WO-1993023054-A1 POLYPHOSPHORYLATED ORGANIC COMPOUNDS: COMPOSITIONS USEFUL IN PROTECTING BIOLOGICAL TISSUES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-11-25 WO disclosed
US-5260287-A Phosphorylated alcohols and polyvalent cations used as antiulcer agents BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 1993-11-09 US disclosed
US-5260287-A Phosphorylated alcohols and polyvalent cations used as antiulcer agents BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 1993-11-09 US disclosed