Trimethylammonium

Trimethylammonium

SCHEMBL2531877

CN(C)C.CN(C)c1ccccc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.62
TSHR P16473 5/20 0.62
HSD17B10 Q99714 2/20 0.62
ALOX15 P16050 2/20 0.62
MAPK1 P28482 3/20 0.56
TDP1 Q9NUW8 3/20 0.56
RELA Q04206 1/20 0.56
RAB9A P51151 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HPGD P15428 2/20 0.52
NPC1 O15118 1/20 0.52
HTT P42858 3/20 0.50
CHKA P35790 3/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
GFER P55789 1/20 0.48
CYP3A4 P08684 2/20 0.48
TP53 P04637 1/20 0.48
CHRM5 P08912 1/20 0.48

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
SCHEMBL7879117 0.97
SCHEMBL21208167 0.97 ALDH1A1 (0.67) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL10557768 0.97 ALDH1A1 (0.67) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL8277 0.97
SCHEMBL16187039 0.97
SCHEMBL4918905 0.93 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10ALOX15MAPK1
Bromide SCHEMBL252099 0.93 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL7983815 0.93 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10ALOX15MAPK1
Water SCHEMBL6758084 0.93 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL17046164 0.93 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10ALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1061212-C Insecticide and acaricide containing optical active compound and preparation method thereof SHANGHAI CHINESE AND WESTERN M (CN) 2001-01-31 CN claimed
US-8815871-B2 N,N-substituted 3-aminopyrrolidine compounds useful as monoamines reuptake inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-08-26 US disclosed
US-8044144-B2 Resin composition, transparent film or sheet having elasticity recovering property, and wrap film PRIME POLYMER CO., LTD. (JP) 2011-10-25 US disclosed
US-20090012238-A1 RESIN COMPOSITION, TRANSPARENT FILM OR SHEET HAVING ELASTICITY RECOVERING PROPERTY, AND WRAP FILM PRIME POLYMER CO., LTD (JP) 2009-01-08 US disclosed
EP-1730203-B1 CATALYST COMPOSITION AND USE THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2008-12-31 EP disclosed