SCHEMBL136839

SCHEMBL136839

C=C(C)C(=O)OCCCC(=O)CC(=O)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
THRB P10828 1/20 0.39
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL6762330 0.97 TSHR (0.45) TSHRTHRBPOLBAPEX1HTT
SCHEMBL15655553 0.94 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
Isopropyl Alcohol SCHEMBL30043507 0.91 TSHR (0.45) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28034640 0.91 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1436455 0.91 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL532367 0.91 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28638019 0.89 TSHR (0.43) TSHRTHRBPOLBAPEX1HTT
SCHEMBL6681423 0.88 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28635731 0.86 TSHR (0.41) TSHRTHRBPOLBAPEX1HTT
SCHEMBL7630614 0.84 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT

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 364 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190091657-A1 HYBRID MATERIAL FOR CHROMATOGRAPHIC SEPARATIONS COMPRISING A SUPERFICIALLY POROUS CORE AND A SURROUNDING MATERIAL WATERS TECHNOLOGIES CORPORATION 2019-03-28 US claimed
US-20190015815-A1 SUPERFICIALLY POROUS MATERIALS COMPRISING A COATED CORE HAVING NARROW PARTICLE SIZE DISTRIBUTION; PROCESS FOR THE PREPARATION THEREOF; AND USE THEREOF FOR CHROMATOGRAPHIC SEPARATIONS WATERS TECHNOLOGIES CORPORATION 2019-01-17 US claimed
EP-3426388-A1 SUPERFICIALLY POROUS MATERIALS COMPRISING A COATED CORE HAVING NARROW PARTICLE SIZE DISTRIBUTION; PROCESS FOR THE PREPARATION THEREOF; AND USE THEREOF FOR CHROMATOGRAPHIC SEPARATIONS Waters Technologies Corporation (US) 2019-01-16 EP claimed
EP-3426389-A1 HYBRID MATERIAL FOR CHROMATOGRAPHIC SEPARATIONS COMPRISING A SUPERFICIALLY POROUS CORE AND A SURROUNDING MATERIAL Waters Technologies Corporation (US) 2019-01-16 EP claimed
US-9670069-B2 Methods of making metal-oxides and uses thereof for water treatment and energy applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-06-06 US claimed
US-9593027-B2 Porous metal oxide and metal oxide-organic nanocomposites, methods of making and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-14 US claimed
US-20140077425-A1 POROUS METAL OXIDE AND METAL OXIDE-ORGANIC NANOCOMPOSITES, METHODS OF MAKING AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2014-03-20 US claimed
EP-2598441-A1 SUPERFICIALLY POROUS MATERIALS COMPRISING A SUBSTANTIALLY NONPOROUS CORE HAVING NARROW PARTICLE SIZE DISTRIBUTION; PROCESS FOR THE PREPARATION THEREOF; AND USE THEREOF FOR CHROMATOGRAPHIC SEPARATIONS Waters Technologies Corporation (US) 2013-06-05 EP claimed
EP-2598440-A2 SUPERFICIALLY POROUS MATERIALS COMPRISING A SUBSTANTIALLY NONPOROUS HYBRID CORE HAVING NARROW PARTICLE SIZE DISTRIBUTION; PROCESS FOR THE PREPARATION THEREOF; AND USE THEREOF FOR CHROMATOGRAPHIC SEPARATIONS Waters Technologies Corporation (US) 2013-06-05 EP claimed
US-20120267321-A1 METHODS OF MAKING METAL-OXIDES AND USES THEREOF FOR WATER TREATMENT AND ENERGY APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-10-25 US claimed
WO-2012018596-A2 SUPERFICIALLY POROUS MATERIALS COMPRISING A SUBSTANTIALLY NONPOROUS HYBRID CORE HAVING NARROW PARTICLE SIZE DISTRIBUTION; PROCESS FOR THE PREPARATION THEREOF; AND USE THEREOF FOR CHROMATOGRAPHIC SEPARATIONS WATERS TECHNOLOGIES CORPORATION (US) 2012-02-09 WO claimed
WO-2010141426-A1 HYBRID MATERIAL FOR CHROMATOGRAPHIC SEPARATIONS WATERS TECHNOLOGIES CORPORATION (US) 2010-12-09 WO claimed
EP-2150402-A1 POROUS INORGANIC/ORGANIC HYBRID PARTICLES HAVING HIGH ORGANIC CONTENT AND ENHANCED PORE GEOMETRY FOR CHROMATOGRAPHIC SEPARATIONS Waters Technologies Corporation (US) 2010-02-10 EP claimed
WO-2009089513-A2 METHODS OF GENERATING SUPPORTED NANOCATALYSTS AND COMPOSITIONS THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-07-16 WO claimed
US-7459320-B2 Method for producing a photovoltaic device PIRELLI & C. S.P.A. (IT) 2008-12-02 US claimed
WO-2008128209-A1 POLYFUNCTIONAL EPOXY OLIGOMERS DESIGNER MOLECULES, INC. (US) 2008-10-23 WO claimed
US-20080206562-A1 METHODS OF GENERATING SUPPORTED NANOCATALYSTS AND COMPOSITIONS THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-08-28 US claimed
WO-2008103423-A1 POROUS INORGANIC/ORGANIC HYBRID PARTICLES HAVING HIGH ORGANIC CONTENT AND ENHANCED PORE GEOMETRY FOR CHROMATOGRAPHIC SEPARATIONS WATERS INVESTMENTS LIMITED (US) 2008-08-28 WO claimed
US-20070178241-A1 Method for producing a photovoltaic device PIRELLI & C. S.P.A. (IT) 2007-08-02 US claimed
WO-2004089543-A1 METHOD FOR PRODUCING FILM OF SEMICONDUCTIVE METAL OXIDE PIRELLI & C. S.P.A. (IT) 2004-10-21 WO claimed