SCHEMBL3748168

SCHEMBL3748168

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

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.42
PGK2 P07205 1/20 0.42
PGD P52209 5/20 0.39
MPI P34949 1/20 0.39
PTPN1 P18031 1/20 0.34
S1PR2 O95136 2/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
S1PR5 Q9H228 1/20 0.33
LPAR5 Q9H1C0 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
SCHEMBL9577585 0.91 PGK1 (0.48) PGK1PGK2PGDMPILPAR5
SCHEMBL15728251 0.91 PGK1 (0.48) PGK1PGK2PGDMPILPAR5
SCHEMBL15270851 0.83 PGD (0.50) PGK1PGK2PGDMPIPTPN1
SCHEMBL3744531 0.83 PGD (0.46) PGK1PGK2PGDMPIPTPN1
SCHEMBL9577648 0.80 PGK1 (0.43) PGK1PGK2PGDMPILPAR5
SCHEMBL9577688 0.80 PGK1 (0.43) PGK1PGK2PGDMPILPAR5
SCHEMBL11567749 0.78 PGK1 (0.42) PGK1PGK2PGDMPILPAR5
SCHEMBL15709615 0.78 PGK1 (0.38) PGK1PGK2PGDMPIPTPN1
SCHEMBL17080278 0.78 PGK1 (0.38) PGK1PGK2PGDMPILPAR5
SCHEMBL15725544 0.78 PGK1 (0.38) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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