Tetrapentylammonium

Tetrapentylammonium

SCHEMBL9460428

CCCCC[N+](CCCCC)(CCCCC)CCCCC.O=C(O)c1ccc([S+]([O-])c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
PLA2G4B P0C869 6/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
RARA P10276 1/20 0.45
MAPT P10636 1/20 0.45
MTOR P42345 1/20 0.45
KMT2A Q03164 1/20 0.45
PLA2G4A P47712 1/20 0.41

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
Tetrapentylammonium SCHEMBL9460120 1.00 RARB (0.46) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460382 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9461094 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
Tetrahexylammonium SCHEMBL9460540 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
Tetrahexylammonium SCHEMBL9460549 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460707 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460436 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460747 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460218 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1
SCHEMBL9460312 0.98 TP53 (0.49) RARBTP53TSHRPLA2G4BMEN1

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
US-5274184-A Aryl sulphide, aryl sulphoxide and aryl sulphone compounds CASSELLA AKTIENGESELLSCHAFT (DE) 1993-12-28 US disclosed