SCHEMBL7554601

SCHEMBL7554601

CC(C)[C@@](C)(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
SCHEMBL5268572 1.00
SCHEMBL7554026 1.00
SCHEMBL22029866 0.80
Toluene SCHEMBL28643692 0.79 CYP2D6 (0.46)
SCHEMBL9823163 0.78
SCHEMBL12691733 0.78 CYP1A2 (0.30)
SCHEMBL9775746 0.78
SCHEMBL7220643 0.77
SCHEMBL62852 0.77
SCHEMBL62851 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1050533-A1 A process for the preparation of chiral imidazolinone herbicides American Cyanamid Company (US) 2000-11-08 EP claimed
US-5973154-A Process for the preparation of chiral imidazolinone herbicides AMERICAN CYANAMID COMPANY (US) 1999-10-26 US claimed
EP-3230274-B1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS Bayer Pharma AG (DE) 2019-01-30 EP disclosed
WO-2016091845-A1 NOVEL ARYL-CYANOGUANIDINE COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-16 WO disclosed
US-6441190-B1 REACTING PYRIDINEDICARBOXYLIC ACID ANHYDRIDE OR PHTHALIC ANHYDRIDE COMPOUND WITH (R)2- AMINO-2,3-DIMETHYLBUTYRONITRILE IN PRESENCE OF WATER-FREE SOLVENT, HYDROLYSIS, TREATING WITH BASE; SEPARATION TO OBTAIN IMIDAZOLINONE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed
US-20020077253-A1 PROCESS FOR THE PREPARATION OF CHIRAL NICOTINIC, QUINOLINIC OR BENZOIC ACID IMIDAZOLINONE HERBICIDES INTELLECTUAL PROPERTY DEPARTMENT (DE) 2002-06-20 US disclosed
US-20020019567-A1 Process for the recovery and recycle of D-tartaric acid AMERICAN CYANAMID COMPANY (US) 2002-02-14 US disclosed
US-6346649-B1 FORMING MONOSODIUM TARTARIC ACID SALTS FROM RACEMIC MIXTURE OF 2,3-DIMETHYLBUTYRONITRILE; ACIDIFICATION BASF AKTIENGESELLSCHAFT (DE) 2002-02-12 US disclosed
US-6339158-B1 REACTING PYRIDINE OR QUINOLINE-2,3-DICARBOXYLIC ACID ANHYDRIDE DERIVATIVE WITH 2-AMINO-2,3-DIMETHYLBUTYRONITRILE IN PRESENCE OF NON-POLAR, WATER-FREE SOLVENT, TERTIARY AMINE, HYDROLYSIS, REACTING WITH BASE, SEPARATION, ACIDIFICATION AMERICAN CYANAMID CO. 2002-01-15 US disclosed
JP-2000319276-A PRODUCTION OF CHIRAL IMIDAZOLINONE HERBICIDE AMERICAN CYANAMID CO 2000-11-21 JP disclosed
EP-1050533-A1 A process for the preparation of chiral imidazolinone herbicides American Cyanamid Company (US) 2000-11-08 EP disclosed
EP-1050533-A1 A process for the preparation of chiral imidazolinone herbicides American Cyanamid Company (US) 2000-11-08 EP disclosed
CN-1272496-A Preparation method of chiral imidazolidinone weedicide AMERICAN CYANAMID CO (US) 2000-11-08 CN disclosed
US-5973154-A Process for the preparation of chiral imidazolinone herbicides AMERICAN CYANAMID COMPANY (US) 1999-10-26 US disclosed
US-5973154-A Process for the preparation of chiral imidazolinone herbicides AMERICAN CYANAMID COMPANY (US) 1999-10-26 US disclosed