SCHEMBL1701168

SCHEMBL1701168

CCCC[N+](CCC)(CCC)CCCC.O=C([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.38
THRB P10828 1/20 0.36
FAAH O00519 8/20 0.33
SLC22A2 O15244 1/20 0.33
CES1 P23141 5/20 0.33
CES2 O00748 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
Tetrabuthylammonium SCHEMBL2184844 0.97 SLC22A1 (0.40) SLC22A1THRBFAAHSLC22A2CES1
Tetrabuthylammonium SCHEMBL9495552 0.97 SLC22A1 (0.40) SLC22A1THRBFAAHSLC22A2CES1
Tetrabuthylammonium SCHEMBL7700891 0.94 SLC22A1 (0.38) SLC22A1THRBFAAHSLC22A2CES1
Tetrapropylammonium SCHEMBL1701184 0.94 THRB (0.41) SLC22A1THRB
Tetrabuthylammonium SCHEMBL4934068 0.90 SLC22A1 (0.43) SLC22A1FAAHSLC22A2CES1CES2
SCHEMBL27556766 0.86 THRB (0.55) SLC22A1THRBFAAHSLC22A2CES1
Tetrabuthylammonium SCHEMBL10527770 0.83 SLC22A1 (0.46) SLC22A1FAAHSLC22A2CES1CES2
Cetrimonium SCHEMBL10869268 0.83 DNM1 (0.46) THRBFAAHCES1CES2KMT2A
Tetrabuthylammonium SCHEMBL10749753 0.82 THRB (0.59) SLC22A1THRBFAAHSLC22A2CES1
Bromide SCHEMBL7939227 0.81 DNM1 (0.46) MEN1KMT2A

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
EP-2591351-B1 APPARATUS AND METHOD FOR DETERMINING ANALYTE CONTENT IN A FLUID ORONO SPECTRAL SOLUTIONS INC (US) 2018-08-22 EP disclosed
US-8613214-B2 Apparatus and method for determining analyte content in a fluid ORONO SPECTRAL SOLUTIONS, INC. (US) 2013-12-24 US disclosed
EP-2591351-A1 APPARATUS AND METHOD FOR DETERMINING ANALYTE CONTENT IN A FLUID Orono Spectral Solutions, Inc. (US) 2013-05-15 EP disclosed
WO-2012005969-A1 APPARATUS AND METHOD FOR DETERMINING ANALYTE CONTENT IN A FLUID ORONO SPECTRAL SOLUTIONS, INC. (US) 2012-01-12 WO disclosed
US-20110162441-A1 APPARATUS AND METHOD FOR DETERMINING ANALYTE CONTENT IN A FLUID ORONO SPECTRAL SOLUTIONS, INC. (US) 2011-07-07 US disclosed
EP-1146956-B1 MICROEMULSIONS CONTAINING WATER AND HYDROFLUOROETHERS 3M INNOVATIVE PROPERTIES CO (US) 2004-02-11 EP disclosed
EP-1146956-A1 MICROEMULSIONS CONTAINING WATER AND HYDROFLUOROETHERS 3M Innovative Properties Company (US) 2001-10-24 EP disclosed
US-6127430-A CLEANING AGENTS, SOLVENTS, AND DELIVERY SYSTEMS; MAY ALSO CONTAIN A FLUORINATED SURFACTANT OR A MIXTURE OF SUCH AND MAY ALSO CONTAIN A COSURFACTANT AND/OR COSOLVENT 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-10-03 US disclosed
WO-2000035571-A1 MICROEMULSIONS CONTAINING WATER AND HYDROFLUOROETHERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-06-22 WO disclosed