SCHEMBL4105293

SCHEMBL4105293

[CH]=C/C=[C]/CCC

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
SCHEMBL5685438 0.75
SCHEMBL4109891 0.75
SCHEMBL5670257 0.71
SCHEMBL7183223 0.69
SCHEMBL7183227 0.69
SCHEMBL7184312 0.67
SCHEMBL7175533 0.67
SCHEMBL7183492 0.65
SCHEMBL7183494 0.65
SCHEMBL121523 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5677298-A USEFUL FOR THE PROPHYLAXIS OR THERAPY OF HYPERCHOLESTEREMIA OR CORONOARY SCLEROSIS OF MAMMALS TAKEDA CHEMICAL INDUSTRIES (JP) 1997-10-14 US claimed
US-20090209510-A1 Novel Method of Treating Hyperlipidemia TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-08-20 US disclosed
US-20090118255-A1 Crp Lowering Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-07 US disclosed
US-20090082333-A1 REMEDY FOR XANTHOMA NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2009-03-26 US disclosed
US-20080227770-A1 Benzoxazepine Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-09-18 US disclosed
EP-1962832-A2 COMBINATIONS OF A QUALENE SYNTHASE INHIBITOR AND A HMG-COA REDUCTASE INHIBITOR FOR TREATING HYPERLIPIDEMIA Takeda Pharmaceutical Company Limited (JP) 2008-09-03 EP disclosed
US-20080132483-A1 Agent for preventing or treating organ functional disorders and organ dysfunction TAKEDA PHARMACEUTICAL COMPANY LIMITED 2008-06-05 US disclosed
US-20080113965-A1 Compound having inhibitory activity against squalene synthase or a salt or prodrug thereof, for example, N-[[(3R,5S)-1-(3-acetoxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetyl]piperidine-4-acetic acid; myalgia or rhabdomyolysis treatment TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-15 US disclosed
US-20080058310-A1 High-density lipoprotein-cholesterol level elevating agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-06 US disclosed
EP-1889632-A1 REMEDY FOR XANTHOMA National University Corp. Kobe University (JP) 2008-02-20 EP disclosed
US-5885979-A SQUALENE SYNTHETASE INHIBITOR TREATING OR PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-23 US disclosed
US-5770438-A CHEMICAL INTERMEDIATES FOR ANTICHOLESTEROL COMPOUNDS, CYCLIZATION TO FORM BENZOXAZEPINE OR BENZOTHIAZEPINE COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-23 US disclosed
US-5726306-A INHIBITORS OF SQUALENE SYNTHETASE AND FUNGAL GROWTH; USEFUL IN TREATING AND PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-10 US disclosed
US-5698691-A ANTICHOLESTEROL AGENT; SYNTHETASE INHIBITOR; FUNGICIDE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-16 US disclosed
US-5677298-A USEFUL FOR THE PROPHYLAXIS OR THERAPY OF HYPERCHOLESTEREMIA OR CORONOARY SCLEROSIS OF MAMMALS TAKEDA CHEMICAL INDUSTRIES (JP) 1997-10-14 US disclosed
EP-0645377-B1 Benzoxazepine derivatives useful as squalene synthetase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-08-13 EP disclosed
EP-0710725-A1 Production of optically active compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-08 EP disclosed
EP-0705607-A2 Condensed seven- or eight-membered heterocyclic compounds useful as antihypertriglyceridemic agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-04-10 EP disclosed
EP-0645378-A1 Condensed seven- or eight-membered heterocyclic compounds useful as squalene synthetase inhibitors Takeda Chemical Industries, Ltd. (JP) 1995-03-29 EP disclosed
EP-0645377-A1 Benzoxazepine derivatives useful as squalene synthetase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-03-29 EP disclosed