Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL796639

CCCC[N+](CCCC)(CCCC)CCCC.OCc1cccc2cc3cc4cc5cccc(CO)c5c(CO)c4c(CO)c3c(CO)c12

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 1/20 0.33
GCGR P47871 6/20 0.32
TLR8 Q9NR97 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALOX5 P09917 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL796940 0.83 MEN1 (0.38) MEN1KMT2A
SCHEMBL7939364 0.69 HTR2A (0.42) MEN1KMT2A
SCHEMBL5696277 0.68 SLC2A1 (0.43) TLR8
Tetrabuthylammonium SCHEMBL3296432 0.67 SLC22A1 (0.60) SLC22A1MEN1KMT2A
SCHEMBL12704930 0.65 HTR2A (0.44) SLC22A1MEN1KMT2A
SCHEMBL5829949 0.64 TLR8 (0.45) TLR8MEN1KMT2AALOX5PTGS2
Tetrabuthylammonium SCHEMBL4750159 0.64 TDP1 (0.50) MEN1KMT2A
Water SCHEMBL20398654 0.64 CYP1A2 (0.41) TLR8
SCHEMBL29061944 0.63 LIPG (0.56) MEN1KMT2AALOX5PTGS2
SCHEMBL17417168 0.63 LIPG (0.43) GCGRALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed