SCHEMBL3440328

SCHEMBL3440328

COc1cc(C)c(S(=O)(=O)N(C)CCC(=O)NC2CCC(NC3CCC(N(C)C)CC3)CC2)c(C)c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 19/20 0.62
MAPT P10636 1/20 0.42

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
SCHEMBL12010143 1.00 BDKRB1 (0.62) BDKRB1MAPT
SCHEMBL12010146 1.00 BDKRB1 (0.62) BDKRB1MAPT
SCHEMBL3440385 0.88 BDKRB1 (0.72) BDKRB1
SCHEMBL3441617 0.88 BDKRB1 (0.75) BDKRB1MAPT
SCHEMBL3440425 0.87 BDKRB1 (0.65) BDKRB1MAPT
SCHEMBL12010160 0.86 BDKRB1 (0.61) BDKRB1
SCHEMBL3440542 0.86 BDKRB1 (0.61) BDKRB1
SCHEMBL12916126 0.86 BDKRB1 (0.61) BDKRB1
SCHEMBL13063365 0.83 BDKRB1 (0.61) BDKRB1
SCHEMBL12010161 0.83 BDKRB1 (0.61) BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188251-B1 ARYLSULFONAMIDES WITH ANALGESIC ACTIVITY BOEHRINGER INGELHEIM INT (DE) 2015-04-29 EP disclosed
EP-2402329-A1 Analgetic phenylsulphonamides Boehringer Ingelheim International GmbH (DE) 2012-01-04 EP disclosed
EP-2284166-A1 Arylsulfonamides with analgetic activity Boehringer Ingelheim International GmbH (DE) 2011-02-16 EP disclosed
WO-2009021758-A1 ARYLSULFONAMIDES HAVING AN ANALGESIC EFFECT BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-19 WO disclosed
WO-2009021946-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-19 WO disclosed
EP-2025675-A1 Arylsulfonamides with analgetic activity Boehringer Ingelheim International GmbH (DE) 2009-02-18 EP disclosed
WO-2008022945-A1 ARYL SULFONAMIDES WITH AN ANALGESIC ACTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-02-28 WO disclosed