SCHEMBL2216482

SCHEMBL2216482

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.43
PGD P52209 3/20 0.33
MPI P34949 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMPD1 P17405 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
PGK1 P00558 1/20 0.31
PGK2 P07205 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
SCHEMBL28033517 1.00 PTPN1 (0.43) PTPN1PGDMPILMNAL3MBTL1
SCHEMBL29431969 0.86 LMNA (0.42) PTPN1PGDMPILMNAL3MBTL1
SCHEMBL29408337 0.86 LMNA (0.42) PTPN1PGDMPILMNAL3MBTL1
SCHEMBL6470157 0.85 PTPN1 (0.47) PTPN1PGDMPILMNASMPD1
SCHEMBL27468464 0.85 LMNA (0.46) PTPN1LMNAL3MBTL1TDP1
SCHEMBL15954307 0.85 PTPN1 (0.51) PTPN1PGDMPISMPD1
SCHEMBL29886751 0.85 LMNA (0.46) PTPN1LMNAL3MBTL1TDP1
SCHEMBL8854308 0.83 PTPN1 (0.41) PTPN1PGDMPISMPD1TDP1
SCHEMBL15270851 0.83 PGD (0.50) PTPN1PGDMPIPGK1PGK2
SCHEMBL3744531 0.83 PGD (0.46) PTPN1PGDMPIPGK1PGK2

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
WO-2013133772-A1 AN INTEGRATED SOLID PHASE EXTRACTION COUPLED ULTRA-PERFORMANCE LIQUID CHROMATOGRAPHY-MASS SPECTROMETRY (SPE-UPLC-MS) METHOD FOR THE PROFILING OF DXP METABOLITES AND SYSTEM DIAGNOSTICS OF DXP PATHWAY NATIONAL UNIVERSITY OF SINGAPORE (SG) 2013-09-12 WO claimed
US-20140128289-A1 METHODS OF PROMOTING WEIGHT LOSS AND ASSOCIATED ARRAYS THE WASHINGTON UNIVERSITY (US) 2014-05-08 US disclosed
WO-2013133772-A1 AN INTEGRATED SOLID PHASE EXTRACTION COUPLED ULTRA-PERFORMANCE LIQUID CHROMATOGRAPHY-MASS SPECTROMETRY (SPE-UPLC-MS) METHOD FOR THE PROFILING OF DXP METABOLITES AND SYSTEM DIAGNOSTICS OF DXP PATHWAY NATIONAL UNIVERSITY OF SINGAPORE (SG) 2013-09-12 WO disclosed
US-20110177976-A1 METHODS FOR PROMOTING WEIGHT LOSS AND ASSOCIATED ARRAYS THE WASHINGTON UNIVERSITY (US) 2011-07-21 US disclosed
WO-2001083769-A9 CRYSTALLIZATION OF 4-DIPHOSPHOCYTIDYL-2-C-METHYLERYTHRITOL SYNTHESIS SALK INST FOR BIOLOGICAL STUDI (US) 2003-02-06 WO disclosed
EP-1198575-A1 ISOPRENOID BIOSYNTHESIS Bacher, Adelbert (DE) 2002-04-24 EP disclosed
WO-2001083769-A2 CRYSTALLIZATION OF 4-DIPHOSPHOCYTIDYL-2-C-METHYLERYTHRITOL SYNTHESIS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2001-11-08 WO disclosed
WO-2001011055-A1 ISOPRENOID BIOSYNTHESIS BACHER ADELBERT (DE) 2001-02-15 WO disclosed