SCHEMBL3533067

SCHEMBL3533067

[CH2]CCc1ccc(C)o1

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
SCHEMBL6475097 0.85 CHRM2 (0.58)
SCHEMBL3534364 0.80
SCHEMBL3723023 0.78
SCHEMBL11839445 0.76
SCHEMBL1362084 0.76
SCHEMBL1868584 0.76
SCHEMBL3183110 0.76
SCHEMBL11033324 0.76 CHRM2 (0.45)
SCHEMBL8143743 0.74 POLB (0.52)
SCHEMBL9864079 0.73 CHRM2 (0.47)

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
CN-111978215-A Benzyl-protected ortho-chiral amino alcohol compound and preparation method thereof 复旦大学 2020-11-24 CN claimed
CN-105722972-A Cellular factors involved in the cytotoxicity of leukocidins of staphylococcus aureus: novel therapeutic target 纽约大学 2016-06-29 CN claimed
CN-102548965-A Substituted amide compounds ASTELLAS PHARMA INC 2012-07-04 CN claimed
US-20100063080-A1 CXCR2 inhibitors PRESS NEIL JOHN 2010-03-11 US claimed
EP-2086947-A1 PYRIMIDINES AND THEIR USE AS CXCR2 RECEPTOR ANTAGONISTS Novartis AG (CH) 2009-08-12 EP claimed
WO-2008061740-A1 PYRIMIDINES AND THEIR USE AS CXCR2 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2008-05-29 WO claimed
EP-0003663-A2 Amino-substituted phenyl and heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-08-22 EP claimed
CN-111978215-A Benzyl-protected ortho-chiral amino alcohol compound and preparation method thereof 复旦大学 2020-11-24 CN disclosed
CN-102548965-B Substituted amide compounds ASTELLAS PHARMA INC 2014-04-09 CN disclosed
EP-2086960-B1 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2014-03-05 EP disclosed
CN-101514168-B Synthesis of 2-hydroxy-n,n-dimethyl-3-[[2-[1(r)-(5-methyl-2-furanyl) propyl]amino]-3,4-dioxo-1-cyclobuten-1-yl]amino]benzamide MERCK SHARP & DOHME 2014-02-26 CN disclosed
CN-101514193-B Synthesis of furan substituted dioxo cyclobutene MERCK SHARP & DOHME 2012-12-19 CN disclosed
CN-102548965-A Substituted amide compounds ASTELLAS PHARMA INC 2012-07-04 CN disclosed
CN-1805947-A Synthesis of 2-hydroxy-N, N-dimethyl-3- [ [ 2- [ [1 - (5-methyl-2-furyl) propyl ] amino ] -3, 4-dioxo-1-cyclobuten-1-yl ] amino ] benzamide SCHERING CORP (US) 2006-07-19 CN disclosed
CN-1247544-C Anthranilic acid amides with heteroarylsulfonyl side chains and their use as antiarrhythmic active substances SANNOFFE AVENTIS DEUTSCHLAND G (DE) 2006-03-29 CN disclosed
CN-1529695-A Anthranilic acid amides with heteroarylsulfonyl side chains, method for the production thereof, use thereof as medicaments or diagnostic agents, and pharmaceutical preparations containing said compounds ������ҽҩ�¹����޹�˾ 2004-09-15 CN disclosed
US-4333940-A Ring-fluorinated 4-(monosubstituted-amino) phenyl compounds in inhibiting atherosclerotic lesion development AMERICAN CYANAMID COMPANY (US) 1982-06-08 US disclosed
US-4243609-A ANTILIPEMIC AGENTS, ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1981-01-06 US disclosed
US-4085109-A Pyridine sulfur flavoring agents FIRMENICH & CIE (CH) 1978-04-18 US disclosed
US-3943260-A TETRAHYDRO-THIO-PHEN-3-ONES FIRMENICH & CIE (CH) 1976-03-09 US disclosed