SCHEMBL3283129

SCHEMBL3283129

Nc1cccnc1N=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
SCHEMBL21167335 0.77
SCHEMBL16310738 0.74 KDM4E (0.44)
SCHEMBL3280497 0.73
SCHEMBL21189180 0.73
SCHEMBL14037823 0.73
SCHEMBL3282357 0.73
SCHEMBL2605755 0.73
SCHEMBL6404182 0.73
SCHEMBL30335428 0.72 GAA (0.44)
SCHEMBL14963882 0.72 RRM1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0943032-B1 MULTICOMPONENT SYSTEM FOR MODIFYING, DECOMPOSING OR BLEACHING LIGNIN OR LIGNIN-CONTAINING MATERIALS, AND PROCESS FOR USING THE SAME CONSORTIUM ELEKTROCHEM IND (DE) 2000-09-13 EP claimed
CN-1240008-A Multicomponent system for modifying, degrading or bleaching lignin, lignin-containing materials or the like and method for the use thereof ELEKTOCHEMISCHE IND GMBH (DE) 1999-12-29 CN claimed
EP-0943032-A1 MULTICOMPONENT SYSTEM FOR MODIFYING, DECOMPOSING OR BLEACHING LIGNIN, LIGNIN-CONTAINING MATERIALS OR SIMILAR SUBSTANCES, AND PROCESS FOR USING THE SAME Consortium für elektrochemische Industrie GmbH (DE) 1999-09-22 EP claimed
WO-1998026127-A1 MULTICOMPONENT SYSTEM FOR MODIFYING, DECOMPOSING OR BLEACHING LIGNIN, LIGNIN-CONTAINING MATERIALS OR SIMILAR SUBSTANCES, AND PROCESS FOR USING THE SAME Consortium für elektrochemische Industrie GmbH (DE) 1998-06-18 WO claimed
EP-0352638-B1 5-Amino-6-pyridazinon-derivatives, process for their preparation and herbicidal agent containing them BASF AG (DE) 1995-02-22 EP claimed
US-5123952-A Postemergence herbicides BASF AKTIENGESELLSCHAFT (DE) 1992-06-23 US claimed
US-7700196-B2 Method for producing carbonyl group-containing organosilicon compounds WACKER CHEMIE AG (DE) 2010-04-20 US disclosed
WO-2009139340-A1 PYRAZOLE COMPOUND 武田薬品工業株式会社 (JP) 2009-11-19 WO disclosed
EP-1685183-B1 METHOD FOR PRODUCING CARBONYL REST-CONTAINING ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2008-01-16 EP disclosed
US-20070129520-A1 High yield of 2-formylethyldimethylsilanol-modified polydimethylsiloxane obtained by the continuous process of oxidizing 3-hydroxypropyldimethylsilanol-modified corresponding polymer using Tempoas an oxidation catalyst and air or oxygen as oxidizer in an aqueous dispersion; industrial scale; low cost WACKER CHEMIE AG (DE) 2007-06-07 US disclosed
US-20060217281-A1 Oxidation system containing a macrocyclic metal complex, the production thereof and its use LANXESS B.V. (NL) 2006-09-28 US disclosed
EP-1685183-A2 METHOD FOR PRODUCING CARBONYL REST-CONTAINING ORGANOSILICON COMPOUNDS Wacker Chemie AG (DE) 2006-08-02 EP disclosed
CN-1761787-A Oxidation system comprising macrocyclic metal complexes, method for the production and use thereof LANXESS B V (NL) 2006-04-19 CN disclosed
EP-0885868-A1 Oxidation-process for the production of aldehydes and ketones in the presence of nitrogen-containing compounds Consortium für elektrochemische Industrie GmbH (DE) 1998-12-23 EP disclosed
EP-0882814-A1 System and process for the electrochemical cleavage of compounds Consortium für elektrochemische Industrie GmbH (DE) 1998-12-09 EP disclosed
WO-1998026127-A1 MULTICOMPONENT SYSTEM FOR MODIFYING, DECOMPOSING OR BLEACHING LIGNIN, LIGNIN-CONTAINING MATERIALS OR SIMILAR SUBSTANCES, AND PROCESS FOR USING THE SAME Consortium für elektrochemische Industrie GmbH (DE) 1998-06-18 WO disclosed
EP-0352638-B1 5-Amino-6-pyridazinon-derivatives, process for their preparation and herbicidal agent containing them BASF AG (DE) 1995-02-22 EP disclosed
US-5123952-A Postemergence herbicides BASF AKTIENGESELLSCHAFT (DE) 1992-06-23 US disclosed
US-5123952-A Postemergence herbicides BASF AKTIENGESELLSCHAFT (DE) 1992-06-23 US disclosed
EP-0352638-A2 5-Amino-6-pyridazinon-derivatives, process for their preparation and herbicidal agent containing them BASF Aktiengesellschaft (DE) 1990-01-31 EP disclosed