Tributylmethylammonium

Tributylmethylammonium

SCHEMBL4921201

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

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 5/20 0.52
CA1 P00915 1/20 0.45
FFAR3 O14843 2/20 0.40
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
FABP3 P05413 5/20 0.37
CA2 P00918 1/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
GRK2 P25098 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL4916812 0.89 CA1 (0.45) BBOX1CA1FFAR3HDAC3HDAC1
SCHEMBL4927998 0.89 BBOX1 (0.46) BBOX1CA1FFAR3HDAC3HDAC1
Tributylmethylammonium SCHEMBL4926215 0.88 BBOX1 (0.51) BBOX1CA1FABP3
Tetrabuthylammonium SCHEMBL2346227 0.87 CA1 (0.47) BBOX1CA1FFAR3HDAC3HDAC1
Tributylmethylammonium SCHEMBL5573568 0.83 FFAR3 (0.61) BBOX1CA1FFAR3HDAC3HDAC1
Tributylmethylammonium SCHEMBL5571629 0.83 BBOX1 (0.67) BBOX1CA1FFAR3HDAC3HDAC1
SCHEMBL4928209 0.81 BBOX1 (0.44) BBOX1CA1FFAR3HDAC3HDAC1
Tetrabuthylammonium SCHEMBL29488100 0.81 CA1 (0.46) BBOX1CA1FABP3
Tributylmethylammonium SCHEMBL5573597 0.81 BBOX1 (0.64) BBOX1CA1FABP3
SCHEMBL4917985 0.81 BBOX1 (0.53) BBOX1CA1FFAR3HDAC3HDAC1

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