Trimethylammonium

Trimethylammonium

SCHEMBL1345929

C=C(CCC)C(=O)O.CN(C)C.CN(C)C.COS(=O)(=O)O

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of Trimethylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
Trimethylammonium SCHEMBL69320 1.00 FFAR3 (0.32) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL4846053 0.94 FFAR3 (0.36) FFAR3HDAC3HDAC1HDAC2HDAC8
Ammonia Solution, Strong SCHEMBL7054400 0.93 FFAR3 (0.34) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6142286 0.92
SCHEMBL10663698 0.92
Methylamine SCHEMBL5692650 0.91 FFAR3 (0.33) FFAR3HDAC3HDAC1HDAC2HDAC8
Trimethylammonium SCHEMBL4972950 0.90 ALDH1A1 (0.37) ALDH1A1
SCHEMBL10893137 0.90 FFAR3 (0.30) FFAR3HDAC3HDAC1HDAC2HDAC8
Sulfuric Acid SCHEMBL8399982 0.89 FFAR3 (0.37) FFAR3HDAC3HDAC1HDAC2HDAC8
Sulfuric Acid SCHEMBL16195481 0.89 FFAR3 (0.37) FFAR3HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2178498-B1 METHOD FOR TREATING DAMAGED HAIR PROCTER & GAMBLE (US) 2018-04-18 EP claimed
EP-1476496-B1 METHOD FOR CONTROLLING THE STABILITY OR THE DROPLETS SIZE OF SIMPLE WATER-IN-OIL EMULSIONS, AND STABILIZED SIMPLE WATER-IN-OIL EMULSIONS RHODIA CHIMIE SA (FR) 2016-07-20 EP claimed
EP-2134312-B1 PERSONAL CARE COMPOSITIONS CONTAINING AT LEAST TWO CATIONIC POLYMERS AND AN ANIONIC SURFACTANT PROCTER & GAMBLE (US) 2014-10-29 EP claimed
EP-2579972-A1 METHOD FOR PREPARING A NON-IONIC SURFACTANT STABLE PERSONAL CARE DISPERSION The Procter and Gamble Company (US) 2013-04-17 EP claimed
EP-2209824-B1 HIGH DEFINITION PRINTING WITH WATERBORNE INKS ON NON-POROUS SUBSTRATES RHODIA (US) 2012-08-08 EP claimed
US-8025918-B2 High definition printing with waterborne inks on non-porous substrates RHODIA, INC. (US) 2011-09-27 US claimed
EP-2209824-A2 HIGH DEFINITION PRINTING WITH WATERBORNE INKS ON NON-POROUS SUBSTRATES Rhodia, Inc. (US) 2010-07-28 EP claimed
EP-1854843-B1 Cosmetic composition comprising a block copolymer RHODIA CHIMIE SA (FR) 2009-09-09 EP claimed
WO-2009065004-A2 HIGH DEFINITION PRINTING WITH WATERBORNE INKS ON NON-POROUS SUBSTRATES RHODIA, INC. (US) 2009-05-22 WO claimed
US-20090130295-A1 High Definition Printing With Waterborne Inks on Non-Porous Substrates RHODIA OPERATIONS (FR) 2009-05-21 US claimed
EP-1490411-B1 METHOD FOR CONTROLLING THE STABILITY OF EMULSIONS AND STABILIZED EMULSIONS RHODIA CHIMIE SA (FR) 2009-01-21 EP claimed
US-7473730-B2 Method for depositing a polymer onto a surface by applying a composition onto said surface RHODIA CHIMIE (FR) 2009-01-06 US claimed
EP-1687348-B1 COPOLYMERS COMPRISING POLYALKYLENE OXIDE GROUPS AND QUATERNARY NITROGEN ATOMS BASF SE (DE) 2008-11-12 EP claimed
US-20080206355-A1 Composition comprising a particulate zinc material, a pyrithione or a polyvalent metal salt of a pyrithione and a synthetic cationic polymer THE PROCTER & GAMBLE COMPANY 2008-08-28 US claimed
EP-1660548-B1 NEW COPOLYMER HAVING A CONTROLLED STRUCTURE, AND USE THEREOF RHODIA (US) 2008-08-27 EP claimed
EP-1453915-B1 COSMETIC COMPOSITION COMPRISING A BLOCK COPOLYMER RHODIA CHIMIE SA (FR) 2007-07-04 EP claimed
EP-0995611-B1 Ink jet recording element EASTMAN KODAK CO (US) 2004-04-07 EP claimed
EP-0995610-B1 Ink jet recording element with overcoat layer EASTMAN KODAK CO (US) 2003-12-03 EP claimed
US-6089704-A Overcoat for ink jet recording element EASTMAN KODAK COMPANY (US) 2000-07-18 US claimed
EP-0995610-A2 Ink jet recording element with overcoat layer EASTMAN KODAK COMPANY (US) 2000-04-26 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080206355-A1 Composition comprising a particulate zinc material, a pyrithione or a polyvalent metal salt of a pyrithione and a synthetic cationic polymer SLC39A3, SLC39A14, SLC30A7 FFAR3 1197/4885HDAC3 1674/4885HDAC1 626/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.