SCHEMBL1039977

SCHEMBL1039977

CC(=N)C(N)=O

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
Hydrochloric Acid SCHEMBL16162588 0.96
SCHEMBL23419577 0.82
Acetamidine SCHEMBL30712355 0.78
Acetamide SCHEMBL27859287 0.78
Acetone SCHEMBL1277371 0.78
Acetamidine SCHEMBL395042 0.75
Acetic Acid SCHEMBL28886845 0.75 FFAR3 (0.58)
SCHEMBL288532 0.75
Acetic Acid SCHEMBL28694434 0.75 FFAR3 (0.58)
SCHEMBL29222480 0.75

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021042171-A1 CANCER IMMUNOTHERAPY Ena Therapeutics Pty Ltd (AU) 2021-03-11 WO disclosed
WO-2017189868-A1 SERINE REPLACEMENT POLYMYXIN ANALOGUES USEFUL AS ANTIBIOTIC POTENTIATORS SPERO OPCO (US) 2017-11-02 WO disclosed
EP-2925721-B1 S1P AND/OR ATX MODULATING AGENTS BIOGEN MA INC (US) 2017-06-07 EP disclosed
CN-103998063-B Polyethylene glycol based prodrugs of adrenomedullin and uses thereof 拜耳制药股份公司 2016-09-21 CN disclosed
CN-103987407-B Pyrrolobenzodiazepines Zhuo and conjugate thereof 麦迪穆有限责任公司 2016-08-24 CN disclosed
CN-102123723-B Glucagon/GLP-1 receptor co-agonists INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORP. (US) 2016-05-25 CN disclosed
EP-2276732-B1 NOVEL ESTROGEN RECEPTOR LIGANDS KAROBIO AB (SE) 2015-05-20 EP disclosed
CN-102459325-B Gastrostatin receptor activated glucagon compounds UNIV INDIANA RES & TECH CORP 2015-03-25 CN disclosed
CN-102933236-B Pyrrolobenzodiazepines and conjugates thereof SPIROGEN LTD. (CH) 2014-10-08 CN disclosed
CN-103998063-A Polyethylene glycol based prodrugs of adrenomedullin and uses thereof Bayer Pharma AG 2014-08-20 CN disclosed
CN-103987407-A Pyrrolobenzodiazepines and conjugates thereof SPIROGEN SARL 2014-08-13 CN disclosed
US-8653072-B2 Estrogen receptor ligands KARO BIO AB (SE) 2014-02-18 US disclosed
US-20130131061-A1 Novel Estrogen Receptor Ligands KARO BIO AB (SE) 2013-05-23 US disclosed
CN-102933236-A Pyrrolobenzodiazepines and conjugates thereof SPIROGEN LTD 2013-02-13 CN disclosed
US-8367665-B2 Estrogen receptor ligands KARO BIO AB (SE) 2013-02-05 US disclosed
US-20110190294-A1 NOVEL ESTROGEN RECEPTOR LIGANDS OASMIA PHARMACEUTICAL AB (SE) 2011-08-04 US disclosed
EP-2276732-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-01-26 EP disclosed
WO-2009127686-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-10-22 WO disclosed
CN-101208306-A Pyrazole compounds and diabetes therapeutic agent containing the same JAPAN TOBACCO INC (JP) 2008-06-25 CN disclosed
CN-1265590-A Substituted alkanohydroxamic acid and method of reducing TNF 'alpha' levels CELGENE CORP (US) 2000-09-06 CN disclosed