SCHEMBL4565604

SCHEMBL4565604

O=C(O)N1CCCCC1CN1c2ccccc2N(c2ccccc2)S1(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 18/20 0.49
SLC6A3 Q01959 7/20 0.47
SLC6A4 P31645 5/20 0.47
KCNH2 Q12809 1/20 0.43
HRH3 Q9Y5N1 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38

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
SCHEMBL4565079 0.86 SLC6A2 (0.40) SLC6A2SLC6A3SLC6A4KCNH2HRH3
SCHEMBL3607020 0.76 SLC6A2 (0.54) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3608735 0.76 SLC6A2 (0.54) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4064766 0.75 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3598010 0.70 SLC6A2 (0.61) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL4565249 0.70 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4
SCHEMBL3616900 0.70 SLC6A2 (0.63) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3617241 0.70 SLC6A2 (0.63) SLC6A2SLC6A3SLC6A4KCNH2
SCHEMBL3608625 0.70 SLC6A2 (0.54) SLC6A2SLC6A3SLC6A4KCNH2
Hydrochloric Acid SCHEMBL3595496 0.69 SLC6A2 (0.60) 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 2 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 disclosed
WO-2008073459-A1 ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-06-19 WO disclosed