Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL795552

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

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.52
SLC22A2 O15244 1/20 0.46
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42
DNM1 Q05193 5/20 0.39
RECQL P46063 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
EPHX2 P34913 1/20 0.36
BLM P54132 1/20 0.36

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
Vinylsulfonic Acid SCHEMBL5912822 0.88 DNM1 (0.59) SLC22A1SLC22A2TSHRALDH1A1TP53
Vinylsulfonic Acid SCHEMBL5912548 0.88 DNM1 (0.59) SLC22A1SLC22A2TSHRALDH1A1TP53
Tetrabuthylammonium SCHEMBL795551 0.87 SLC22A1 (0.52) SLC22A1SLC22A2TSHRALDH1A1TP53
Tetrabuthylammonium SCHEMBL243898 0.84 SLC22A1 (0.67) SLC22A1SLC22A2TSHRALDH1A1TP53
Tetrabuthylammonium SCHEMBL9935681 0.82 SLC22A1 (0.46) SLC22A1SLC22A2TSHRALDH1A1TP53
Vinylsulfonic Acid SCHEMBL5376237 0.82 DNM1 (0.58) TSHRSMN1; SMN2HSD17B10DNM1
Cetrimonium SCHEMBL5380726 0.82 DNM1 (0.58) TSHRSMN1; SMN2HSD17B10DNM1
Tetrabuthylammonium SCHEMBL20550033 0.81 SLC22A1 (0.63) SLC22A1SLC22A2TSHRALDH1A1TP53
Tetrabuthylammonium SCHEMBL331035 0.81 SLC22A1 (0.63) SLC22A1SLC22A2TSHRALDH1A1TP53
Tetrabuthylammonium SCHEMBL24418 0.81 SLC22A1 (0.63) SLC22A1SLC22A2TSHRALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10586995-B2 Method for the fabrication of homogenous blends of polystyrenesulfonic acid and polyvinylidene fluoride suitable for the application in direct oxidation methanol fuel cells (DMFCs) UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2020-03-10 US disclosed
CN-102883602-B Method for reducing virulence of bacteria UWM研究基金会有限公司 2017-07-18 CN disclosed
US-20160049678-A1 New Method for the Fabrication of Homogenous Blends of Polystyrenesulfonic Acid and Polyvinylidene Fluoride Suitable For The Application In Direct Oxidation Methanol Fuel Cells (DMFCs) UNIVERSITY OF SOUTHERN CALIFORNIA 2016-02-18 US disclosed
US-9260382-B2 Methods of reducing virulence in bacteria UWM RESEARCH FOUNDATION (US) 2016-02-16 US disclosed
US-20130267571-A1 TERPENOID ANALOGUES AND USES THEREOF FOR TREATING NEUROLOGICAL CONDITIONS NEUROQUEST INC. (CA) 2013-10-10 US disclosed
EP-2616056-A1 TERPENOID ANALOGUES AND USES THEREOF FOR TREATING NEUROLOGICAL CONDITIONS Neuroquest Inc. (CA) 2013-07-24 EP disclosed
EP-2536275-A1 METHODS OF REDUCING VIRULENCE IN BACTERIA UWM Research Foundation, Inc. (US) 2012-12-26 EP disclosed
US-20120322769-A1 METHODS OF REDUCING VIRULENCE IN BACTERIA DUKE UNIVERSITY (US) 2012-12-20 US disclosed
WO-2012034232-A1 TERPENOID ANALOGUES AND USES THEREOF FOR TREATING NEUROLOGICAL CONDITIONS NEUROQUEST INC. (CA) 2012-03-22 WO disclosed
WO-2011103189-A1 METHODS OF REDUCING VIRULENCE IN BACTERIA UWM RESEARCH FOUNDATION, INC. (US) 2011-08-25 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 (2 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-20120322769-A1 METHODS OF REDUCING VIRULENCE IN BACTERIA PGLS, RRS1, MRPL21 SLC22A1 3445/4885SLC22A2 3854/4885TSHR 1669/4885
US-20130267571-A1 TERPENOID ANALOGUES AND USES THEREOF FOR TREATING NEUROLOGICAL CONDITIONS PMP22, PTGES, GGPS1 SLC22A1 868/4885SLC22A2 936/4885TSHR 3693/4885

“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.