Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL1702368

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

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.39
FABP3 P05413 7/20 0.38
CA1 P00915 1/20 0.37
SLC22A2 O15244 1/20 0.34

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 SCHEMBL17748421 0.87 CA1 (0.41) SLC22A1FABP3CA1
Didecyldimethylammonium SCHEMBL1703968 0.85 DNM1 (0.44) FABP3
Glyphosate SCHEMBL1701849 0.83 BBOX1 (0.32)
Glyphosate SCHEMBL1702309 0.79 CA2 (0.40) FABP3CA1
Glyphosate SCHEMBL3665222 0.78 FOLH1 (0.38) CA1
Glyphosate SCHEMBL18450 0.78 CA4 (0.39) CA1
Glyphosate SCHEMBL9756253 0.78 CA4 (0.35) CA1
Glyphosate SCHEMBL9947944 0.78 CA4 (0.35) CA1
Glyphosate SCHEMBL7194092 0.78 CA4 (0.35) CA1
Glyphosate SCHEMBL18414 0.78 CA12 (0.37) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130109572-A1 HERBICIDAL COMPOSITIONS AND METHODS OF USE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2013-05-02 US disclosed
WO-2012006313-A2 HERBICIDAL COMPOSITIONS AND METHODS OF USE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2012-01-12 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-20130109572-A1 HERBICIDAL COMPOSITIONS AND METHODS OF USE DDT, ACHE, CAT SLC22A1 1069/4885FABP3 1948/4885CA1 1082/4885

“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.