SCHEMBL4064766

SCHEMBL4064766

CC(C)(C)OC(=O)N1CCCCC1CCN1c2ccccc2N(c2ccccc2)S1(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.48
SLC6A4 P31645 6/20 0.48
SLC6A3 Q01959 5/20 0.46
KCNH2 Q12809 1/20 0.45
KDM1A O60341 1/20 0.42
NR1H2 P55055 2/20 0.40
NR1H3 Q13133 2/20 0.40

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
SCHEMBL4064772 0.91 KDM1A (0.42) SLC6A2SLC6A4KDM1ANR1H2NR1H3
SCHEMBL4062683 0.82 GPR119 (0.55) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3605054 0.80 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4063156 0.80 GPR119 (0.51) SLC6A2SLC6A4
SCHEMBL4565495 0.77 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3KCNH2NR1H2
SCHEMBL4058421 0.76 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4565604 0.75 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4059662 0.75 GPR119 (0.53) SLC6A2SLC6A4SLC6A3
SCHEMBL3616311 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3600086 0.75 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2

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