SCHEMBL1963806

SCHEMBL1963806

N#CCC1(CC#N)CC1

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
SCHEMBL2154171 0.87 ALDH1A1 (0.33)
SCHEMBL15160716 0.87
SCHEMBL2155471 0.84 ALDH1A1 (0.38)
SCHEMBL597712 0.82
SCHEMBL14671534 0.82
SCHEMBL23730626 0.82
SCHEMBL6216216 0.82
SCHEMBL992402 0.82
SCHEMBL25004733 0.82
SCHEMBL642970 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11031626-B2 Electrolytic solution and electrochemical device containing the same NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2021-06-08 US disclosed
US-20200099101-A1 ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE CONTAINING THE SAME NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2020-03-26 US disclosed
EP-3191441-B1 NOVEL PROCESS FOR PREPARATION OF SPIRO[2.5]OCTANE-5,7-DIONE AND SPIRO[3.5]NONANE-6,8-DIONE BOEHRINGER INGELHEIM INT TRADING SHANGHAI CO LTD (CN) 2020-02-19 EP disclosed
EP-2880008-B1 PROCESS FOR PREPARING SPIRO[2.5]OCTANE-5,7-DIONE BOEHRINGER INGELHEIM INT (DE) 2019-05-29 EP disclosed
EP-2880008-B1 PROCESS FOR PREPARING SPIRO[2.5]OCTANE-5,7-DIONE BOEHRINGER INGELHEIM INT (DE) 2019-05-29 EP disclosed
US-9212120-B2 Process for preparing spiro[2.5]octane-5,7-dione BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-12-15 US disclosed
US-9212120-B2 Process for preparing spiro[2.5]octane-5,7-dione BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-12-15 US disclosed
US-9212120-B2 Process for preparing spiro[2.5]octane-5,7-dione BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-12-15 US disclosed
EP-2880008-A1 PROCESS FOR PREPARING SPIRO[2.5]OCTANE-5,7-DIONE Boehringer Ingelheim International GmbH (DE) 2015-06-10 EP disclosed
US-20140336405-A1 Process for preparing spiro[2.5]octane-5,7-dione BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-11-13 US disclosed
WO-2008058118-A2 PREPARATION OF MONTELUKAST AND ITS SALTS DR. REDDY'S LABORTORIES, LTD. (IN) 2008-05-15 WO disclosed
WO-2006018284-A1 COMPOUNDS AND COMPOSITIONS USEFUL AS CATHEPSIN S INHIBITORS NOVARTIS AG (CH) 2006-02-23 WO disclosed
EP-0870763-B1 Condensed piperidine derivatives used as a nitrogen monoxide synthase inhibitors ONO PHARMACEUTICAL CO (JP) 2001-12-12 EP disclosed
US-6228866-B1 ADMINISTERING NITRIC OXIDE SYNTHASE INHIBITOR TO TREAT CANCER AND NERVOUS SYSTEM, BRAIN, KIDNEY, RESPIRATORY SYSTEM, AUTOIMMUNES, SKIN AND MUSCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD. (JP) 2001-05-08 US disclosed
US-6110930-A NITRIC OXIDE SYNTHASE INHIBITOR ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-29 US disclosed
EP-0870763-A1 Condensed piperidine derivatives used as a nitrogen monoxide synthase inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed
EP-0442820-B1 Benzimidazole and azabenzimidazole derivatives, thromboxane receptor antagonists, processes for their preparation, synthesis intermediates, compositions containing them UNION PHARMA SCIENT APPL (FR) 1995-09-13 EP disclosed
US-5128359-A Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation LABORATOIRES UPSA (FR) 1992-07-07 US disclosed
US-5124336-A Cardiovascular disorders LABORATOIRES UPSA (FR) 1992-06-23 US disclosed
EP-0442820-A1 Benzimidazole and azabenzimidazole derivatives, thromboxane receptor antagonists, processes for their preparation, synthesis intermediates, compositions containing them LABORATOIRES UPSA (FR) 1991-08-21 EP disclosed