Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL8968691

CCCC[N+](CCCC)(CCCC)CCCC.O=S(=O)(O)CCCCCCNc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.46
KCNH3 Q9ULD8 1/20 0.43
MAPT P10636 1/20 0.42
GHSR Q92847 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
NAAA Q02083 1/20 0.41
EPHX2 P34913 1/20 0.41
PLK1 P53350 1/20 0.40
ELANE P08246 2/20 0.40
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
GGPS1 O95749 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
Tetrabuthylammonium SCHEMBL8969602 0.96 EPHX1 (0.43) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL1606652 0.85 ALDH1A1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL1607454 0.85 ALDH1A1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL8969772 0.85 ALDH1A1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL1607516 0.85 ALDH1A1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL8968708 0.84 ALDH1A1 (0.55) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL8969890 0.84 ALDH1A1 (0.55) EPHX1ALDH1A1HTTKCNH3MAPT
Sulfuric Acid SCHEMBL22117415 0.84 EPHX1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
Sulfuric Acid SCHEMBL22117414 0.84 EPHX1 (0.57) EPHX1ALDH1A1HTTKCNH3MAPT
SCHEMBL8968746 0.84 ALDH1A1 (0.55) EPHX1ALDH1A1HTTKCNH3MAPT

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-5510532-A ANILINE DERIVATIVES CONTAINING ALKYLSULFONATE GROUP ON NITROGEN ATOM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-04-23 US disclosed
US-5500474-A POLYANILINE SULFONATES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1996-03-19 US disclosed