Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL333475

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.O=S(=O)([O-])O.[OH-]

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CYP51cyp51Acyp51c

The experimentally established mechanism targets of Tetrabuthylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 3/20 0.57
SLC22A2 O15244 1/20 0.50
TP53 P04637 2/20 0.46
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
DNM1 Q05193 4/20 0.42
RECQL P46063 2/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
EPHX2 P34913 1/20 0.39
BLM P54132 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 SCHEMBL1756146 0.98 SLC22A1 (0.60) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL24419 0.98 SLC22A1 (0.60) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL9795117 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL317532 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL28112570 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL10581121 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL1072246 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL7396013 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL2313513 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1
Tetrabuthylammonium SCHEMBL27893784 0.95 SLC22A1 (0.57) SLC22A1SLC22A2TP53TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435351-B2 Enamide process SUNOVION PHARMACEUTICALS INC. (US) 2019-10-08 US disclosed
WO-2018144385-A1 ENAMIDE PROCESS SUNOVION PHARMACEUTICALS INC. (US) 2018-08-09 WO disclosed
US-20180215702-A1 ENAMIDE PROCESS SUNOVION PHARMACEUTICALS INC. 2018-08-02 US disclosed
US-10011559-B2 Preparation of chiral amides and amines SUNOVION PHARMACEUTICALS INC. (US) 2018-07-03 US disclosed
US-20180016224-A1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC. 2018-01-18 US disclosed
EP-2816024-B1 Chiral amines SUNOVION PHARMACEUTICALS INC (US) 2017-08-02 EP disclosed
US-20160016891-A1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC. 2016-01-21 US disclosed
EP-2013835-B1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC (US) 2015-11-04 EP disclosed
EP-2816024-A1 Chiral amines Sunovion Pharmaceuticals Inc. (US) 2014-12-24 EP disclosed
US-20140057990-A1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC. (US) 2014-02-27 US disclosed
US-8524950-B2 Preparation of chiral amides and amines SUNOVION PHARMACEUTICALS INC. (US) 2013-09-03 US disclosed
US-20120095106-A1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC. (US) 2012-04-19 US disclosed
US-8097760-B2 Preparation of chiral amides and amines Sunovion Pharmacuticals Inc. (US) 2012-01-17 US disclosed
US-20090149549-A1 PREPARATION OF CHIRAL AMIDES AND AMINES SUNOVION PHARMACEUTICALS INC. 2009-06-11 US disclosed
EP-2013835-A2 PREPARATION OF CHIRAL AMIDES AND AMINES Sepracor Inc. (US) 2009-01-14 EP disclosed
WO-2007115185-A2 PREPARATION OF CHIRAL AMIDES AND AMINES SEPRACOR INC. (US) 2007-10-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10011559-B2 Preparation of chiral amides and amines PNMT, ALKBH5, ALKBH2 SLC22A1 3461/4885SLC22A2 3240/4885TP53 3186/4885
US-20180016224-A1 PREPARATION OF CHIRAL AMIDES AND AMINES PNMT, ALKBH2, ALKBH5 SLC22A1 3744/4885SLC22A2 3524/4885TP53 3144/4885
US-20160016891-A1 PREPARATION OF CHIRAL AMIDES AND AMINES PNMT, ALKBH5, ALKBH2 SLC22A1 3461/4885SLC22A2 3240/4885TP53 3186/4885
US-20090149549-A1 PREPARATION OF CHIRAL AMIDES AND AMINES PNMT, ALKBH5, ALKBH2 SLC22A1 3461/4885SLC22A2 3240/4885TP53 3186/4885
US-20120095106-A1 PREPARATION OF CHIRAL AMIDES AND AMINES PNMT, ALKBH5, ALKBH2 SLC22A1 3461/4885SLC22A2 3240/4885TP53 3186/4885
US-20180215702-A1 ENAMIDE PROCESS ENO1, ENY2, ALKBH2 SLC22A1 4191/4885SLC22A2 3647/4885TP53 3986/4885
US-10435351-B2 Enamide process ENO1, ENY2, ALKBH2 SLC22A1 4191/4885SLC22A2 3647/4885TP53 3986/4885
US-20140057990-A1 PREPARATION OF CHIRAL AMIDES AND AMINES PNMT, ALKBH5, ALKBH2 SLC22A1 3461/4885SLC22A2 3240/4885TP53 3186/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.