Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL8970333

CCCC[N+](CCCC)(CCCC)CCCC.O=S(=O)(O)CCCCCCNc1ccccc1Cl

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
CISD1 Q9NZ45 6/20 0.41
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CNR2 P34972 3/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
HPGD P15428 1/20 0.36
PTGS2 P35354 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
Tetrabuthylammonium SCHEMBL8968975 1.00 L3MBTL1 (0.44) L3MBTL1CISD1MEN1TP53CYP1A2
Tetrabuthylammonium SCHEMBL8970327 0.89 L3MBTL1 (0.43) L3MBTL1CISD1MEN1TP53CYP1A2
SCHEMBL8968894 0.87 KMT2A (0.42) L3MBTL1MEN1CYP1A2CYP3A4TSHR
SCHEMBL8970364 0.87 KMT2A (0.42) L3MBTL1MEN1CYP1A2CYP3A4TSHR
SCHEMBL12226555 0.83 KMT2A (0.44) MEN1CYP1A2CYP3A4TSHRCYP2C19
Tetrabuthylammonium SCHEMBL8968691 0.82 EPHX1 (0.46) L3MBTL1HTTEPHX2
SCHEMBL28732815 0.81 ABL1 (0.49) L3MBTL1CISD1MEN1TP53CYP1A2
Tetrabuthylammonium SCHEMBL8969602 0.78 EPHX1 (0.43) L3MBTL1HTT
SCHEMBL10797282 0.77 KMT2A (0.42) MEN1CYP1A2CYP3A4TSHRCYP2C19
SCHEMBL9069882 0.75 NR4A2 (0.53) L3MBTL1MEN1CYP1A2CYP3A4CYP2C19

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