SCHEMBL2163324

SCHEMBL2163324

O=C([O-])OO.O=C([O-])OO.O=C([O-])OO.O=C([O-])OO.O=C([O-])OO.[Fe+2].[Fe+3]

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.33
CA4 P22748 1/20 0.33
FAHD1 Q6P587 1/20 0.33
CA2 P00918 1/20 0.31
CA9 Q16790 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
SCHEMBL27815704 0.96 CA1 (0.36) CA1CA4FAHD1CA2CA9
SCHEMBL1445922 0.96 CA4 (0.36) CA1CA4FAHD1
SCHEMBL1778894 0.92 CA1 (0.33) CA1CA4FAHD1
SCHEMBL1778898 0.92 CA1 (0.33) CA1CA4FAHD1CA2CA9
Water SCHEMBL2172472 0.92 CA1 (0.33) CA1CA4FAHD1CA2CA9
SCHEMBL9492690 0.87 CA4 (0.36) CA1CA4FAHD1
SCHEMBL147956 0.87 CA4 (0.36) CA1CA4FAHD1
SCHEMBL123336 0.87 CA4 (0.36) CA1CA4FAHD1
SCHEMBL8619595 0.87 CA4 (0.36) CA1CA4FAHD1
SCHEMBL23592 0.87 CA4 (0.36) CA1CA4FAHD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051190-B2 Use of an oxyhydroxy salt related to the family of lamellar double hydroxides for the design and manufacture of an electrode with a view to storing electrical energy UNIVERSITE HENRI POINCARE NANCY 1 (FR) 2015-06-09 US disclosed
US-20110183201-A1 USE OF AN OXYHYDROXY SALT RELATED TO THE FAMILY OF LAMELLAR DOUBLE HYDROXIDES FOR THE DESIGN AND MANUFACTURE OF AN ELECTRODE WITH A VIEW TO STORING ELECTRICAL ENERGY UNIVERSITE HENRI POINCARE NANCY 1 (FR) 2011-07-28 US disclosed