SCHEMBL4056089

SCHEMBL4056089

OS1(O)N(CCCCNC2CC2)c2ccccc2N1c1ccccc1F

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.51
SLC6A4 P31645 7/20 0.51
SLC6A3 Q01959 5/20 0.46

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
SCHEMBL4060785 0.96 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL4055249 0.91 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL4942321 0.90 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL4062392 0.89 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL4947134 0.88 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL4057911 0.87 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL4061957 0.86 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL4055434 0.86 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL4944957 0.86 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL4056088 0.86 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3

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