SCHEMBL2911929

SCHEMBL2911929

CS(=O)(=O)CNC[C@@H](O)CN1[C@@H]2C[CH]C[C@@]1(C(N)=O)CC2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL5727484 1.00
SCHEMBL2985550 1.00
SCHEMBL17162480 1.00
SCHEMBL2909263 1.00
SCHEMBL2913695 1.00
SCHEMBL17162469 1.00
Hydrochloric Acid SCHEMBL2918760 0.99
SCHEMBL3043623 0.90
SCHEMBL3792793 0.90
SCHEMBL3038336 0.87 PER2 (0.38)

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 149 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11642339-B2 Methods of treating symptoms of gastroparesis using velusetrag THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-05-09 US claimed
US-20190030022-A1 METHODS OF TREATING SYMPTOMS OF GASTROPARESIS USING VELUSETRAG THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-01-31 US claimed
EP-2419104-B1 COMBINATIONS OF 5-HT4 RECEPTOR AGONISTS AND ACETYLCHOLINESTERASE INHIBITORS FOR TREATMENT OF COGNITIVE DISORDERS THERAVANCE BIOPHARMA R&D IP LLC (US) 2017-11-08 EP claimed
US-9402840-B2 Crystalline form of a quinolinone-carboxamide compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-08-02 US claimed
US-20160095849-A1 CRYSTALLINE FORM OF A QUINOLINONE-CARBOXAMIDE COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-04-07 US claimed
US-9126994-B2 Crystalline form of a quinolinone-carboxamide compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-09-08 US claimed
US-20140256769-A1 CRYSTALLINE FORM OF A QUINOLINONE-CARBOXAMIDE COMPOUND THERAVANCE, INC. (US) 2014-09-11 US claimed
US-20140057939-A1 5-HT4 RECEPTOR AGONIST COMPOUNDS FOR TREATMENT OF COGNITIVE DISORDERS THERAVANCE, INC. (US) 2014-02-27 US claimed
US-8658671-B2 Crystalline form of a quinolinone-carboxamide compound THERAVANCE, INC. (US) 2014-02-25 US claimed
US-8404711-B2 5-HT4 receptor agonist compounds for treatment of cognitive disorders THERAVANCE, INC. (US) 2013-03-26 US claimed
EP-1831211-B1 INDAZOLE-CARBOXAMIDE COMPOUNDS THERAVANCE INC (US) 2010-06-02 EP claimed
US-7728004-B2 crystalline hydrochloride salt of 1-isopropyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid {(1S,3R,5R)-8-[(R)-2-hydroxy-3-(methanesulfonyl-methyl-amino)propyl]-8-azabicyclo[3.2.1]oct-3-yl}amide or solvate thereof; treating disease associated with 5-HT4 receptor activity; gastrointestinal tract disorder THERAVANCE, INC. (US) 2010-06-01 US claimed
EP-1735304-B1 QUINOLINONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE INC (US) 2009-01-07 EP claimed
US-20080287486-A1 Prokinetic agent for bowel preparation THERAVANCE, INC. 2008-11-20 US claimed
US-7419989-B2 Indazole-carboxamide compounds THERAVANCE, INC. (US) 2008-09-02 US claimed
US-20080176895-A1 Quinolinone-carboxamide compounds as 5-HT4, receptor agonists ALFASIGMA S.P.A. (IT) 2008-07-24 US claimed
US-7375114-B2 Quinolinone-carboxamide compounds as 5-HT4 receptor agonists THERAVANCE, INC. (US) 2008-05-20 US claimed
US-20060229332-A1 crystalline hydrochloride salt of 1-isopropyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid {(1S,3R,5R)-8-[(R)-2-hydroxy-3-(methanesulfonyl-methyl-amino)propyl]-8-azabicyclo[3.2.1]oct-3-yl}amide or solvate thereof; treating disease associated with 5-HT4 receptor activity; gastrointestinal tract disorder THERAVANCE, INC. 2006-10-12 US claimed
US-20060135764-A1 Indazole-carboxamide compounds THERAVANCE, INC. 2006-06-22 US claimed
US-20050228014-A1 Quinolinone-carboxamide compounds as 5-HT4 receptor agonists THERAVANCE, INC. 2005-10-13 US claimed