SCHEMBL7148368

SCHEMBL7148368

CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@H](OC(C)=O)C[C@@H]1OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.47
CA12 O43570 10/20 0.47
CA1 P00915 10/20 0.47
CA9 Q16790 8/20 0.47
CYP2D6 P10635 1/20 0.47
THRB P10828 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.43
TSHR P16473 2/20 0.40
NR3C1 P04150 1/20 0.40
FYN P06241 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADRA2B P18089 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL7902314 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL26500505 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL8212779 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL7150774 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL8212776 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL23350664 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL7150597 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL26500528 1.00 CA2 (0.47) CA2CA12CA1CA9CYP2D6
SCHEMBL7903233 0.91 CA2 (0.45) CA2CA12CA1CA9CYP2D6
SCHEMBL13494907 0.91 CA2 (0.45) CA2CA12CA1CA9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130004979-A1 GLYCOSYLTRANSFERASE REVERSIBILITY FOR SUGAR NUCLEOTIDE SYNTHESIS AND MICROSCALE SCANNING WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-03 US 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-6197963-B1 TETRAHYDROPYRAN DERIVATIVES; PROTEIN G, SOMATOSTATIN, AND NATURAL KILLER CELL RECEPTOR ANTAGONISTS OR MIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2001-03-06 US disclosed
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 US disclosed
US-6030942-A TO TREAT CANCER AND VIRAL AND BACTERIAL INFECTIONS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2000-02-29 US disclosed
US-5811512-A BINDING TO G-PROTEIN-LINKED RECEPTORS, SUBSTANCE P RECEPTOR; HORMONE INHIBITORS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1998-09-22 US 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
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
US-5552534-A COMPOUNDS FOR CROSS REACTION WITH PEPTIDES FOR BINDING G PROTEIN THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1996-09-03 US 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
WO-1993017032-A1 TECHNIQUES AND INTERMEDIATES FOR PREPARING NON-PEPTIDE PEPTIDOMIMETICS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1993-09-02 WO disclosed