SCHEMBL4444683

SCHEMBL4444683

CC(=O)C(=O)CC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.36
CA4 P22748 3/20 0.35
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
CA1 P00915 2/20 0.32

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
SCHEMBL11352444 0.78 TDP1 (0.35)
SCHEMBL123396 0.75
SCHEMBL6857048 0.73 CES1 (0.38) CES1CA4TSHRTHPOCA1
SCHEMBL3230536 0.73 OR51E2 (0.40) CA4
SCHEMBL23927231 0.73 CA4 (0.32) CA4
SCHEMBL31203280 0.71 LDHA (0.33) CA4
Fluoride SCHEMBL23927232 0.71 OR51E2 (0.38) CA4
SCHEMBL2392558 0.71 CA4 (0.36) CA4
Acetic Acid SCHEMBL288009 0.71 HMGCR (0.46) TSHR
SCHEMBL25398009 0.70 TET2 (0.38) TSHR

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
US-8758946-B2 Electrolyte suitable for use in a lithium ion cell or battery GINER, INC. (US) 2014-06-24 US disclosed
US-7479530-B2 Polymer having charged units COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-01-20 US disclosed
US-20080193855-A1 A lithium salt, a lithium ion solvating solvent; and fluorinated solvent; high dielectric constant, a low viscosity and a high flashpoint GINER, INC. 2008-08-14 US disclosed
US-20050238692-A1 Biomedical adhesive COMMONWEALTH SCIENTIFIC & INDUSTRIAL RESEARCH ORGANISATION 2005-10-27 US disclosed
US-20050228120-A1 Polymer having charged units COMMONWEALTH SCIENTIFIC & INDUSTRIAL RESEARCH 2005-10-13 US disclosed
EP-1364663-A1 Ocular devices with functionalized surface with adhesive properties COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2003-11-26 EP disclosed
US-5369125-A Cholesterol-lowering agents MERCK & CO., INC. (US) 1994-11-29 US disclosed
WO-1994002134-A1 CHOLESTEROL-LOWERING AGENTS MERCK & CO., INC. (US) 1994-02-03 WO disclosed