SCHEMBL772996

SCHEMBL772996

CN(C=O)C1CCCC1

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
SCHEMBL1679242 0.97 ADH1A (1.00) —
SCHEMBL772457 0.97 ADH1A (1.00) —
SCHEMBL1678872 0.97 ADH1A (1.00) —
SCHEMBL967159 0.97 — —
SCHEMBL308431 0.88 — —
Ethyne SCHEMBL20506470 0.83 — —
Bicarbonate SCHEMBL10721946 0.79 ADH1A (0.62) —
SCHEMBL13744423 0.79 ADH1A (0.62) —
SCHEMBL24230521 0.77 ADH1A (0.60) —
SCHEMBL1569623 0.77 ADH1A (0.60) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104918940-B Purine inhibitors of human phosphatidylinositol 3-kinase 默沙东公司 2017-03-08 — — CN claimed
EP-1906945-B1 HCV INHIBITORS VIROBAY INC (US) 2015-08-05 — — EP claimed
US-20250214960-A1 COMPOUNDS HAVING ACTIVITY OF DEGRADING GSPT1 AND APPLICATION THEREOF SHANGHAI BIOPARTNERSX CO., LTD. (CN) 2025-07-03 — — US disclosed
WO-2023078410-A1 COMPOUND HAVING ACTIVITY OF DEGRADING GSPT1 AND APPLICATION THEREOF 上海美志医药科技有限公司 2023-05-11 — — WO disclosed
WO-2020029846-A1 RAPID SYNTHESIS METHOD FOR BIOMASS-BASED AMINE COMPOUND 南京农业大学 2020-02-13 — — WO disclosed
CN-109310695-A COMPOUNDS AND METHODS FOR TREATING NEUROLOGICAL AND CARDIOVASCULAR CONDITIONS 阿斯特罗赛特制药公司 2019-02-05 — — CN disclosed
EP-2318355-B1 1,1'-DIADAMANTYL CARBOXYLIC ACIDS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE BOEHRINGER INGELHEIM INT (DE) 2018-09-12 — — EP disclosed
CN-104918940-B Purine inhibitors of human phosphatidylinositol 3-kinase 默沙东公司 2017-03-08 — — CN disclosed
US-9408392-B2 Compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-08-09 — — US disclosed
EP-2831046-B1 N-CYCLYLAMIDES AS NEMATICIDES SYNGENTA PARTICIPATIONS AG (CH) 2016-07-13 — — EP disclosed
EP-2627631-B1 PYRROLIDINONES AS METAP2 INHIBITORS MERCK PATENT GMBH (DE) 2015-12-16 — — EP disclosed
US-20060167246-A1 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2006-07-27 — — US disclosed
US-20010001101-A1 Phenanthroline derivatives ZENECA LIMITED 2001-05-10 — — US disclosed
US-5916898-A ANTIFIBROPROLIFERTIVE, ENZYME INHIBITORS OF PYROLYL 4-HYDROXYLASE, ANTIARTHRITIC AGENTS ZENECA LIMITED (GB) 1999-06-29 — — US disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 — — US disclosed
US-5224987-A Aqueous carriers with colors and tertiary amide penetrants E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-07-06 — — US disclosed
EP-0517262-A1 Trifluorothymidine derivatives, process for producing the same and anti-cancer agent containing the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-12-09 — — EP disclosed
US-5084449-A Bactericides and antiprotozoa agents DR. KARL THOMAE GMBH (DE) 1992-01-28 — — US disclosed
US-4992430-A Anti-bacterial compositions comprising a substituted bis-(4-aminophenyl)-sulfone and a dihydro-folic acid reductase DR. KARL THOMAE GMBH (DE) 1991-02-12 — — US disclosed
US-4829058-A INHIBITORS OF BACTERIA, MYCOBACTERIA AND PLASMODIA DR. KARL THOMAE GMBH (DE) 1989-05-09 — — US disclosed
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