Tributylmethylammonium

Tributylmethylammonium

SCHEMBL4928385

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

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.44
TSHR P16473 2/20 0.37
CES1 P23141 6/20 0.37
CA1 P00915 1/20 0.37
CES2 O00748 5/20 0.36
DNM1 Q05193 1/20 0.33
SLC22A1 O15245 1/20 0.33
FABP3 P05413 2/20 0.32

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
Methacrylic Acid SCHEMBL4928137 0.88 ACHE (0.45) TSHRCES1CA1DNM1
Methacrylic Acid SCHEMBL4921851 0.87 BBOX1 (0.38) BBOX1TSHRCES1CA1CES2
Tributylmethylammonium SCHEMBL1052293 0.87 BBOX1 (0.50) BBOX1CES1CA1CES2DNM1
Tributylmethylammonium SCHEMBL557386 0.87 BBOX1 (0.50) BBOX1CES1CA1CES2DNM1
Tetrabuthylammonium SCHEMBL2352834 0.85 SLC22A1 (0.52) TSHRCES1CES2DNM1SLC22A1
Tributylmethylammonium SCHEMBL9790243 0.85 BBOX1 (0.48) BBOX1CES1CA1CES2DNM1
Tributylmethylammonium SCHEMBL4357063 0.84 BBOX1 (0.52) BBOX1CES1CA1CES2DNM1
Tributylmethylammonium SCHEMBL1052295 0.83 BBOX1 (0.47) BBOX1TSHRCES1CA1CES2
Methacrylic Acid SCHEMBL30792554 0.82 BBOX1 (0.53) BBOX1DNM1
Tributylmethylammonium SCHEMBL8995786 0.82 BBOX1 (0.50) BBOX1CES1CA1CES2DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US claimed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP claimed
US-20080312351-A1 Tetraalkylammonium Carboxylate Salts as Trimerization Catalysts for Spray Foam Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-12-18 US disclosed
EP-2003157-A2 Tetraalkylammonium carboxylate salts as trimerization catalysts for spray foam applications Air Products and Chemicals, Inc. (US) 2008-12-17 EP disclosed