Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL8417072

CCCC[N+](CCCC)(CCCC)CCCC.O=C([O-])CS(=O)(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.50
ALDH1A1 P00352 5/20 0.48
HSD11B1 P28845 1/20 0.48
MGLL Q99685 2/20 0.41
KMT2A Q03164 6/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 3/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39

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
Tetrylammonium SCHEMBL8418461 0.86 PKM (0.55) PKMALDH1A1HSD11B1KMT2AMAPT
Tetramethylammonium Ion SCHEMBL8416583 0.84 PKM (0.58) PKMALDH1A1HSD11B1KMT2AMAPT
Tetramethylammonium Ion SCHEMBL8418460 0.84 PKM (0.58) PKMALDH1A1HSD11B1KMT2AMAPT
SCHEMBL29669638 0.78 ALDH1A1 (0.55) PKMALDH1A1HSD11B1MGLLKMT2A
Tetrabuthylammonium SCHEMBL8578186 0.78 CA1 (0.62) ALDH1A1MGLLKMT2AMAPTLMNA
Tetrabuthylammonium SCHEMBL28251083 0.77 ALDH1A1 (0.54) ALDH1A1MGLLKMT2AMAPTMEN1
Tetrabuthylammonium SCHEMBL16968724 0.75 MAPT (0.49) ALDH1A1MGLLKMT2AMAPTMEN1
Tetrabuthylammonium SCHEMBL8765480 0.75 CA1 (0.57) ALDH1A1KMT2AMAPTMEN1LMNA
SCHEMBL30426244 0.74 ALDH1A1 (0.56) PKMALDH1A1MGLLKMT2AMAPT
SCHEMBL11134832 0.74 ALDH1A1 (0.56) PKMALDH1A1MGLLKMT2AMAPT

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
EP-0605285-B1 Tetra-alkylammonium phenylsulfonylacetate thermal-dye-bleach agents MINNESOTA MINING & MFG (US) 1999-09-08 EP disclosed
EP-0605286-B1 Thermal-dye-bleach construction MINNESOTA MINING & MFG (US) 1998-06-24 EP disclosed
EP-0659581-B1 Stabilized thermal-dye-bleach constructions MINNESOTA MINING & MFG (US) 1997-10-15 EP disclosed
EP-0659581-A2 Stabilized thermal-dye-bleach constructions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-06-28 EP disclosed
US-5395747-A Polylactones as stabilizers in antihalation systems where an anion is thermally generated to decolor dyes formed by scattered light MINNESOTA MINING & MANUFACTURING COMPANY (US) 1995-03-07 US disclosed
US-5384237-A Quaternary-ammonium phenylsulfonylacetate thermal-dye-bleach agents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-01-24 US disclosed
EP-0605285-A1 Tetra-alkylammonium phenylsulfonylacetate thermal-dye-bleach agents MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-07-06 EP disclosed
EP-0605286-A1 Thermal-dye-bleach construction MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-07-06 EP disclosed
US-5324627-A Thermal carbanion generating agent MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-06-28 US disclosed
US-5314795-A Thermal-dye-bleach construction comprising a polymethine dye and a thermal carbanion-generating agent MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-05-24 US disclosed