Trimethylammonium

Trimethylammonium

SCHEMBL2521116

CCCC(O)OC(N)=O.CN(C)C

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
LMNA P02545 3/20 0.35
TSHR P16473 3/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AKR1A1 P14550 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
HRH1 P35367 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
SCHEMBL1132886 0.94
Hydrogen Sulfide SCHEMBL27279456 0.91 TSHR (0.42) CHRNB2CHRNB4CHRNA3CHRNA4LMNA
Diethyl Sulfide SCHEMBL27693273 0.84 LMNA (0.33) LMNATSHRCHRM1CHRM3CHRM2
SCHEMBL27674743 0.82 METAP2 (0.33) LMNATSHRCHRM1CHRM3CHRM2
SCHEMBL3423347 0.81 CA2 (0.47) LMNATSHRCHRM1CHRM3CHRM2
SCHEMBL8472259 0.75 CHRM1 (0.40) LMNATSHRCHRM1CHRM3AKR1A1
SCHEMBL88486 0.75
SCHEMBL27788645 0.73 CHRM1 (0.32) TSHRCHRM1CHRM3AKR1A1HTR2A
SCHEMBL7005415 0.73
SCHEMBL17805629 0.73 CTSK (0.42) CHRNB2CHRNB4CHRNA3CHRNA4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9683309-B2 Process for electrospinning chitin fibers from chitinous biomass solution BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2017-06-20 US disclosed
EP-2257669-B1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF UNIV ALABAMA (US) 2017-03-22 EP disclosed
US-9394375-B2 Compositions containing recyclable ionic liquids for use in biomass processing BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2016-07-19 US disclosed
US-20160082141-A1 CHITIN AND ALGINATE COMPOSITE FIBERS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA 2016-03-24 US disclosed
US-8668807-B2 Ionic liquid systems for the processing of biomass, their components and/or derivatives, and mixtures thereof BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2014-03-11 US disclosed
US-20140027938-A1 PROCESS FOR ELECTROSPINNING CHITIN FIBERS FROM CHITINOUS BIOMASS SOLUTION AND FIBERS AND ARTICLES PRODUCED THEREBY BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2014-01-30 US disclosed
US-20120245336-A1 COMPOSITIONS CONTAINING RECYCLABLE IONIC LIQUIDS FOR USE IN BIOMASS PROCESSING BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-09-27 US disclosed
US-20110251377-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2011-10-13 US disclosed
US-20100319862-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2010-12-23 US disclosed
EP-2257669-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF The Board Of Trustees Of The University Of Alabama (US) 2010-12-08 EP disclosed
WO-2010056790-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2010-05-20 WO disclosed
WO-2009105236-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2009-08-27 WO disclosed

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-20110251377-A1 IONIC LIQUID SYSTEMS FOR THE PROCESSING OF BIOMASS, THEIR COMPONENTS AND/OR DERIVATIVES, AND MIXTURES THEREOF IPMK, AGL, PGLS CHRNB2 4541/4885CHRNB4 4653/4885CHRNA3 4544/4885

“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.