SCHEMBL4053883

SCHEMBL4053883

CNCCCN1c2cccc(C)c2N(c2ccccc2)S1(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.56
SLC6A3 Q01959 6/20 0.56
SLC6A4 P31645 5/20 0.54
KCNH2 Q12809 1/20 0.47

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
SCHEMBL4054033 0.87 SLC6A2 (0.68) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4053887 0.85 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4059296 0.84 SLC6A2 (0.71) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4053618 0.81 SLC6A2 (0.74) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4053530 0.81 SLC6A2 (0.72) SLC6A2SLC6A3SLC6A4KCNH2
Hydrochloric Acid SCHEMBL4947356 0.80 SLC6A2 (0.70) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4055131 0.80 SLC6A2 (0.65) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4059516 0.79 SLC6A2 (0.67) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4052758 0.78 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4064534 0.78 SLC6A2 (0.69) SLC6A2SLC6A3SLC6A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061776-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE Wyeth a Corporation of the State of Delaware (US) 2009-05-27 EP claimed
WO-2008073459-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 WO claimed
EP-2061776-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE Wyeth a Corporation of the State of Delaware (US) 2009-05-27 EP disclosed
WO-2008073459-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 WO disclosed