SCHEMBL1728210

SCHEMBL1728210

O=C(Cl)c1[c]cccc1

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
SCHEMBL143892 0.80 ALDH1A1 (0.38)
SCHEMBL1809 0.78
SCHEMBL11324395 0.78
SCHEMBL26572 0.76
SCHEMBL1727779 0.76
SCHEMBL1728206 0.76
SCHEMBL1728266 0.76
SCHEMBL55042 0.76
SCHEMBL7277104 0.76
SCHEMBL8804677 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180022698-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2018-01-25 US claimed
EP-3206683-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA The Board of Trustees of the Leland Stanford Junior University (US) 2017-08-23 EP claimed
WO-2016061538-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-04-21 WO claimed
US-6262098-B1 ISOXAZOLE ESTROGEN RECEPTOR AGONIST AND ANTAGONIST CHIRON CORPORATION 2001-07-17 US claimed
WO-2023129116-A2 A DRUG FOR THE TREATMENT OF TYPE 2 DIABETES MELLITUS DISEASE AND THE NANOPARTICLE THEREOF GAZIANTEP UNIVERSITESI REKTORLUGU (TR) 2023-07-06 WO disclosed
CN-106699687-B A kind of KGA/GAC and/or GDH inhibitor compound containing selenium HANGZHOU JIAMA BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 2019-11-01 CN disclosed
US-20190106387-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2019-04-11 US disclosed
US-20180022698-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2018-01-25 US disclosed
EP-3206683-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA The Board of Trustees of the Leland Stanford Junior University (US) 2017-08-23 EP disclosed
CN-106699687-A Seleniferous KGA (Ketoglulonic Acid) / GAC (Granular Activated Carbon) and / or GDH (Glutamate Dehydrogenase) inhibitor compound 杭州伽玛生物科技有限公司 2017-05-24 CN disclosed
WO-2016061538-A1 NOVEL METHODS, COMPOUNDS, AND COMPOSITIONS FOR ANESTHESIA THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-04-21 WO disclosed
EP-2356103-B1 NOVEL PYRAZOLONE-DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS TAKEDA GMBH (DE) 2015-08-26 EP disclosed
US-5820992-A SEMIPERMEABLE MEMBRANE; GAS SEPARATION; AROMATIC POLYESTER NATIONAL CHEMICAL LABORATORY (IN) 1998-10-13 US disclosed
US-5606000-A BISPHENOL-TYPE MONOMER AND A DICARBOXY-DIPHENYLSILANE MONOMER; SEMIPERMEABLE MEMBRANE NATIONAL CHEMICAL LABORATORY (IN) 1997-02-25 US disclosed
EP-0255890-A1 Process for the reaction of amines with heterocyclic reactive compounds BAYER AG (DE) 1988-02-17 EP disclosed
EP-0047536-B1 SUBSTITUTED PROPYLAMINES ELI LILLY AND COMPANY (US) 1984-06-27 EP disclosed
EP-0013936-B1 REACTIVE AZO DYESTUFFS, THEIR PREPARATION AND THEIR USE IN DYEING MATERIALS CONTAINING HYDROXYL GROUPS AND AMIDE GROUPS BAYER AG (DE) 1982-09-22 EP disclosed
EP-0047536-A2 Substituted propylamines ELI LILLY AND COMPANY (US) 1982-03-17 EP disclosed
US-3928590-A Ortho-mercaptoaroylamides and salts thereof as hypoglycemic agents AMERICAN HOME PROD 1975-12-23 US disclosed
US-3853876-A ORTHO-MERCAPTOAROYLAMIDES AND SALTS THEREOF ABSTRACT OF THE DISCLOSURE AMERICAN HOME PROD 1974-12-10 US disclosed