SCHEMBL588539

SCHEMBL588539

CC(=N)NC#N

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
SCHEMBL1191168 0.72
SCHEMBL2486612 0.69
SCHEMBL315661 0.69
Methyl Alcohol SCHEMBL17389869 0.69
SCHEMBL1937505 0.69
SCHEMBL5333983 0.69
SCHEMBL1818413 0.68
SCHEMBL1103777 0.67
SCHEMBL5384194 0.67
SCHEMBL1818257 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5178834-A None JP disclosed
JP-5178833-A None JP disclosed
CN-111808018-B Production process of acetamiprid 青岛恒宁生物科技有限公司 2022-06-14 CN disclosed
EP-3248968-A1 RESORCINOL DERIVATIVE AS HSP90 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2017-11-29 EP disclosed
US-20170283340-A1 ALKYL THIOPHOSPHORIC TRIAMIDE AND NEEM OIL SOLVENT SYSTEMS FOR USE IN AGRICULTURAL APPLICATIONS RHODIA OPERATIONS (FR) 2017-10-05 US disclosed
US-20170050895-A1 HIGH TEMPERATURE AMINE-STABILIZED DCD AND/OR ALKYL THIOPHOSPHORIC TRIAMIDE SOLVENT SYSTEMS AND USE IN AGRICULTURAL APPLICATIONS RHODIA OPERATIONS (FR) 2017-02-23 US disclosed
CN-106008363-A Environment-friendly preparation method of 2-methyl-4-amino-5-cyanopyrimidine 新发药业有限公司 2016-10-12 CN disclosed
US-20160107947-A1 SOLVENT SYSTEMS FOR DICYANDIAMIDE AND/OR ALKYL THIOPHOSPHORIC TRIAMIDE AND USE IN AGRICULTURAL APPLICATIONS RHODIA OPERATIONS (FR) 2016-04-21 US disclosed
US-9266789-B2 Liquid dicyandiamide and/or alkyl thiophosphoric triamide compositions and their use in agricultural applications RHODIA OPERATIONS (FR) 2016-02-23 US disclosed
US-8962830-B2 Protein kinase inhibitors and methods of treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2015-02-24 US disclosed
EP-2049488-A2 N'-CYANO-N-ALKYL HALIDE IMIDE AMIDE DERIVATIVES Bayer CropScience AG (DE) 2009-04-22 EP disclosed
WO-2008108235-A2 PESTICIDAL COMPOSITION AND METHOD FOR CONTROLLING A PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-12 WO disclosed
WO-2008009360-A2 N'-CYANO-N-ALKYL HALIDE IMIDE AMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-01-24 WO disclosed
JP-H05178834-A PRODUCTION OF N-CYANOACETAMIDINE DERIVATIVE NIPPON SODA CO LTD 1993-07-20 JP disclosed
JP-H05178833-A PRODUCTION OF N-CYANOACETAMIDINE DERIVATIVE NIPPON SODA CO LTD 1993-07-20 JP disclosed
EP-0239533-B1 PYRIDINE DERIVATIVES CIBA-GEIGY AG (CH) 1992-09-16 EP disclosed
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
EP-0239533-A1 Pyridine derivatives CIBA-GEIGY AG (CH) 1987-09-30 EP disclosed
EP-0051067-A1 TRIAZINE SYNTHESIS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1982-05-12 EP disclosed
WO-1981003020-A1 TRIAZINE SYNTHESIS COMMW SCIENT IND RES ORG (AU) 1981-10-29 WO disclosed