Tributylmethylammonium

Tributylmethylammonium

SCHEMBL9936102

C=CCS(=O)(=O)O.CCCC[N+](C)(CCCC)CCCC

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
DNM1 Q05193 1/20 0.30
SLC22A1 O15245 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
Tetrabuthylammonium SCHEMBL9935686 0.87 SLC22A1 (0.46) TSHRALDH1A1ZDHHC20ZDHHC2DNM1
SCHEMBL9935791 0.84 SLC22A1 (0.38) TSHRALDH1A1ZDHHC20ZDHHC2DNM1
SCHEMBL9934681 0.84 DNM1 (0.42) TSHRALDH1A1ZDHHC20ZDHHC2DNM1
Tributylmethylammonium SCHEMBL9935355 0.82 TSHR (0.39) ENPP2TSHRALDH1A1
SCHEMBL9934338 0.82 DNM1 (0.52) ENPP2TSHRDNM1
SCHEMBL9935057 0.82 DNM1 (0.52) ENPP2TSHRDNM1
Pentadecane SCHEMBL27822400 0.82 TSHR (0.46) TSHRALDH1A1ZDHHC20ZDHHC2
Tributylmethylammonium SCHEMBL9936098 0.81 BBOX1 (0.36) TSHRALDH1A1DNM1SLC22A1
SCHEMBL9935875 0.80
Tributylmethylammonium SCHEMBL9935588 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546609-B2 Ionic liquid containing allylsulfonate anion WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-10-01 US disclosed
EP-2474527-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION Wako Pure Chemical Industries, Ltd. (JP) 2012-07-11 EP disclosed
US-20120157680-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-06-21 US 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-20120157680-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION ATXN2L, ARL1, INPPL1 ENPP2 1623/4885TSHR 2384/4885ALDH1A1 3717/4885

“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.