SCHEMBL5444302

SCHEMBL5444302

OC[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LGALS1 P09382 2/20 0.59
LGALS3 P17931 2/20 0.59
LGALS9 O00182 1/20 0.59
LGALS8 O00214 1/20 0.59
ALDH1A1 P00352 2/20 0.48
TSHR P16473 2/20 0.48
LMNA P02545 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
GBA1 P04062 1/20 0.44
PYGB P11216 6/20 0.43
GAA P10253 1/20 0.43
OGA O60502 1/20 0.42

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
SCHEMBL5446587 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL5444372 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL15370355 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL24115372 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL389614 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL24243426 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL5444368 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL18537039 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL18383814 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1
SCHEMBL13197779 1.00 LGALS1 (0.59) LGALS1LGALS3LGALS9LGALS8ALDH1A1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244791-A1 METHODS AND ENZYMES FOR PRODUCING HYDROXYMETHYLFURFURAL UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2016-08-25 US disclosed
US-9068041-B2 Polyester EA toner comprising furan XEROX CORPORATION (US) 2015-06-30 US disclosed
US-9068041-B2 Polyester EA toner comprising furan XEROX CORPORATION (US) 2015-06-30 US disclosed
WO-2015048452-A2 METHODS AND ENZYMES FOR PRODUCING HYDROXYMETHYLFURFURAL THE UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-02 WO disclosed
US-20140170547-A1 Polyester EA Toner Comprising Furan XEROX CORPORATION (US) 2014-06-19 US disclosed
US-20140170547-A1 Polyester EA Toner Comprising Furan XEROX CORPORATION (US) 2014-06-19 US disclosed
US-20070155971-A1 Chiral diphosphorus compounds and their transition metal complexes Source Global, PBC 2007-07-05 US disclosed
US-7193092-B2 Chiral diphosphorus compounds and their transition metal complexes LANXESS DEUTSCHLAND GMBH (DE) 2007-03-20 US disclosed
EP-1400527-B1 Chiral diphosphorus compounds and transition metal complexes thereof LANXESS DEUTSCHLAND GMBH (DE) 2006-03-22 EP disclosed
EP-1398319-B1 Chiral monophosphorus compounds and transition metal complexes thereof LANXESS DEUTSCHLAND GMBH (DE) 2005-11-09 EP disclosed
EP-1398319-A1 Chiral monophosphorus compounds and transition metal complexes thereof Bayer Chemicals AG (DE) 2004-03-17 EP disclosed
US-6562514-B1 Stabilized vanadium electrolyte solutions for all-vanadium redox cells and batteries PINNACLE VRB LIMITED (AU) 2003-05-13 US disclosed
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 US disclosed
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 US disclosed
EP-0829104-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1998-03-18 EP disclosed
EP-0729648-A4 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LTD (AU) 1997-01-02 EP disclosed
WO-1996035239-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-11-07 WO disclosed
EP-0729648-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-09-04 EP disclosed
WO-1995012219-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1995-05-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070155971-A1 Chiral diphosphorus compounds and their transition metal complexes CDIPT, DCPS, PIN1 LGALS1 2769/4885LGALS3 1935/4885LGALS9 2158/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.