SCHEMBL3744531

SCHEMBL3744531

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGD P52209 4/20 0.46
MPI P34949 1/20 0.46
PGK1 P00558 1/20 0.44
PGK2 P07205 1/20 0.44
PTPN1 P18031 1/20 0.39
LPAR5 Q9H1C0 1/20 0.34
SGPL1 O95470 2/20 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
SCHEMBL15270851 0.84 PGD (0.50) PGDMPIPGK1PGK2PTPN1
SCHEMBL3748168 0.83 PGK1 (0.42) PGDMPIPGK1PGK2PTPN1
SCHEMBL2216482 0.83 PTPN1 (0.43) PGDMPIPGK1PGK2PTPN1
SCHEMBL28033517 0.83 PTPN1 (0.43) PGDMPIPGK1PGK2PTPN1
SCHEMBL15728251 0.83 PGK1 (0.48) PGDMPIPGK1PGK2LPAR5
SCHEMBL9577585 0.83 PGK1 (0.48) PGDMPIPGK1PGK2LPAR5
SCHEMBL420874 0.82 PTPN1 (0.41) PGDMPIPGK1PGK2PTPN1
SCHEMBL6837508 0.82 PGD (0.44) PGDMPIPGK1PGK2LPAR5
SCHEMBL18091160 0.79 PTPN1 (0.43) PGDMPIPTPN1LPAR5
E968 SCHEMBL18341349 0.79 PGD (0.57) PGDMPIPGK1PGK2LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236784-B2 Composition comprising threitol phosphate and salts thereof SUNNY BIODISCOVERY, INC. (US) 2012-08-07 US claimed
US-20100291185-A1 THERITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2010-11-18 US claimed
WO-2008144352-A1 THREITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2008-11-27 WO claimed
US-8236784-B2 Composition comprising threitol phosphate and salts thereof SUNNY BIODISCOVERY, INC. (US) 2012-08-07 US disclosed
US-8236784-B2 Composition comprising threitol phosphate and salts thereof SUNNY BIODISCOVERY, INC. (US) 2012-08-07 US disclosed
US-20100291185-A1 THERITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2010-11-18 US disclosed
US-20100291185-A1 THERITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2010-11-18 US disclosed
WO-2008144352-A1 THREITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2008-11-27 WO disclosed
WO-2008144352-A1 THREITOL PHOSPHATES, SALTS THEREOF AND METHODS OF USE SUNNY BIODISCOVERY, INC. (US) 2008-11-27 WO disclosed