Tetrahexylammonium

Tetrahexylammonium

SCHEMBL6618528

CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.O=S(=O)([O-])OOS(=O)(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.47
TSHR P16473 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
EPHX2 P34913 1/20 0.47
BLM P54132 1/20 0.47
SLC22A1 O15245 3/20 0.46
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HIF1A Q16665 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SLC22A2 O15244 1/20 0.43
DNM1 Q05193 4/20 0.42

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
SCHEMBL6621643 1.00 RECQL (0.47) RECQLTSHRGLAHPGDMAPK1
SCHEMBL6619377 0.95 DNM1 (0.52) RECQLTSHRGLAHPGDMAPK1
Tetrabuthylammonium SCHEMBL6617823 0.95 SLC22A1 (0.44) RECQLTSHRGLAHPGDMAPK1
Tetrahexylammonium SCHEMBL7662222 0.91 SLC22A1 (0.56) RECQLTSHRGLAHPGDMAPK1
SCHEMBL6616485 0.91 SLC22A1 (0.56) RECQLTSHRGLAHPGDMAPK1
SCHEMBL6617390 0.90 DNM1 (0.50) RECQLTSHRGLAHPGDMAPK1
Tetrapropylammonium SCHEMBL6619011 0.87 CA2 (0.40) RECQLTSHRGLAHPGDMAPK1
SCHEMBL6617795 0.85 DNM1 (0.61) RECQLTSHRGLAHPGDMAPK1
Tetrabuthylammonium SCHEMBL991019 0.85 SLC22A1 (0.55) RECQLTSHRGLAHPGDMAPK1
Tetrabuthylammonium SCHEMBL27774570 0.85 SLC22A1 (0.55) RECQLTSHRGLAHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985664-B1 Method of producing pyrrolidine derivatives TORAY FINECHEMICALS CO LTD (JP) 2004-03-31 EP disclosed
US-6479668-B1 Method of producing pyrrolidine derivatives TORAY INDUSTRIES, INC. (JP) 2002-11-12 US disclosed
EP-0985664-A2 Method of producing pyrrolidine derivatives TORAY INDUSTRIES, INC. (JP) 2000-03-15 EP disclosed