SCHEMBL7154472

SCHEMBL7154472

Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@@H](Br)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA9 Q16790 1/20 0.40
CYP3A4 P08684 2/20 0.39
VDR P11473 1/20 0.38
RECQL P46063 1/20 0.38
LGALS3 P17931 3/20 0.38
LGALS9 O00182 2/20 0.38
LGALS1 P09382 2/20 0.38
STAT3 P40763 1/20 0.38
FOLH1 Q04609 1/20 0.38
POLB P06746 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
KMT2A Q03164 1/20 0.37
LGALS7; LGALS7B P47929 1/20 0.37
MAPT P10636 1/20 0.36
CA12 O43570 2/20 0.36
CA4 P22748 2/20 0.36
CA5A P35218 2/20 0.36

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
SCHEMBL7154478 1.00 CA1 (0.40) CA1CA2CA9CYP3A4VDR
SCHEMBL11723798 0.85 CA12 (0.47) CA1CA2CA9CA12CA4
SCHEMBL11723808 0.85 CA12 (0.47) CA1CA2CA9CA12CA4
SCHEMBL5680059 0.85 LGALS3 (0.49) CA1CA2CA9CYP3A4LGALS3
SCHEMBL20149723 0.82 CA1 (0.44) CA1CA2CA9CYP3A4LGALS3
SCHEMBL16256918 0.82 FOLH1 (0.38) CA1CA2CA9CYP3A4RECQL
SCHEMBL4306018 0.82 LGALS3 (0.47) CA1CA2CA9CYP3A4LGALS3
SCHEMBL1775668 0.80 NT5E (0.47) CA1CA2CA9LGALS3LGALS9
SCHEMBL18279683 0.78 PTPN1 (0.51) CA1CA2LGALS3LGALS9LGALS1
SCHEMBL18279682 0.78 PTPN1 (0.51) CA1CA2LGALS3LGALS9LGALS1

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-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