SCHEMBL3961886

SCHEMBL3961886

CN(C)CCc1c[nH]c2ccc(NS(=O)(=O)c3ccc4cc(Cl)ccc4c3)cc12

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.76
HTR7 P34969 1/20 0.62
HTR5A P47898 1/20 0.62
SLC6A4 P31645 1/20 0.53

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
SCHEMBL3957568 0.97 HTR6 (0.75) HTR6HTR7HTR5ASLC6A4
SCHEMBL3148443 0.91 HTR6 (0.82) HTR6HTR7HTR5A
SCHEMBL3958843 0.89 HTR6 (0.69) HTR6HTR7HTR5A
SCHEMBL3958067 0.87 HTR6 (0.67) HTR6HTR7HTR5ASLC6A4
SCHEMBL1423485 0.87 HTR6 (1.00) HTR6HTR7HTR5A
SCHEMBL3960589 0.86 HTR6 (0.68) HTR6HTR7HTR5ASLC6A4
SCHEMBL13588646 0.83 HTR6 (0.81) HTR6HTR7HTR5A
SCHEMBL1576283 0.83 HTR6 (0.69) HTR6HTR7HTR5A
SCHEMBL3148768 0.82 HTR6 (1.00) HTR6HTR7HTR5A
SCHEMBL4967568 0.81 HTR6 (0.70) HTR6HTR7HTR5A

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
WO-2009036955-A1 NAPHTYL-SUBSTITUTED SULFONAMIDES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-03-26 WO claimed
EP-2036888-A1 Naphthyl-substituted sulfonamides Laboratorios del Dr. Esteve S.A. (ES) 2009-03-18 EP claimed
WO-2009036955-A1 NAPHTYL-SUBSTITUTED SULFONAMIDES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-03-26 WO disclosed
WO-2009036955-A1 NAPHTYL-SUBSTITUTED SULFONAMIDES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-03-26 WO disclosed
EP-2036888-A1 Naphthyl-substituted sulfonamides Laboratorios del Dr. Esteve S.A. (ES) 2009-03-18 EP disclosed