SCHEMBL1013020

SCHEMBL1013020

COC(=O)C=CN(C)C

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
SCHEMBL1406175 1.00
SCHEMBL28350812 0.85 HCAR2 (0.44)
SCHEMBL29084262 0.84 NFE2L2 (0.43)
SCHEMBL28045540 0.83 MAPT (0.56)
SCHEMBL21126429 0.81 TDP1 (0.46)
SCHEMBL14790719 0.78 NFE2L2 (0.52)
SCHEMBL15962307 0.77
SCHEMBL17528621 0.77 NFE2L2 (0.50)
Dimethyl Fumarate SCHEMBL41836 0.76 NFE2L2 (1.00)
Dimethyl Maleate SCHEMBL75864 0.76 NFE2L2 (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515614-A Synthesis method of difluoro pyrazole acid 南京大学 2024-08-20 CN claimed
CN-117850088-A Ultrathin flexible polarizing cover plate, preparation method thereof and touch display device 深圳市鑫晶科光电设备有限公司 2024-04-09 CN claimed
CN-115193419-B Magnetic microsphere, preparation method, application and diagnostic kit thereof 苏州纳微生命科技有限公司 2022-11-22 CN claimed
CN-115193419-A Magnetic microsphere, preparation method, application and diagnostic kit thereof 苏州纳微生命科技有限公司 2022-10-18 CN claimed
EP-2195284-B1 PROCESS FOR PREPARING 2-DIHALOACYL-3-AMINOACRYLIC ACID DERIVATIVES BAYER IP GMBH (DE) 2017-03-22 EP claimed
EP-2245001-B1 Method for the production of 2-fluoroacyl-3-amino-acrylic acid derivatives BAYER CROPSCIENCE AG (DE) 2013-03-20 EP claimed
US-8288582-B2 Method for the production of 2-fluoroacyl-3-aminoacrylic acid derivatives BAYER CROPSCIENCE AG (DE) 2012-10-16 US claimed
US-8258335-B2 Process for preparing 2-dihaloacyl-3-aminoacrylic acid derivatives BAYER CROPSCIENCE AG (DE) 2012-09-04 US claimed
EP-1458670-B1 METHOD FOR PRODUCING 2-HALOGENACYL-3-AMINO-ACRYLIC ACID DERIVATIVES SALTIGO GMBH (DE) 2011-03-09 EP claimed
EP-2245001-A1 METHOD FOR THE PRODUCTION OF 2-FLUOROACYL-3-AMINO-ACRYLIC ACID DERIVATIVES Bayer CropScience AG (DE) 2010-11-03 EP claimed
US-20100204483-A1 PROCESS FOR PREPARING 2-DIHALOACYL-3-AMINOACRYLIC ACID DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-08-12 US claimed
EP-2195284-A1 PROCESS FOR PREPARING 2-DIHALOACYL-3-AMINOACRYLIC ACID DERIVATIVES Bayer CropScience AG (DE) 2010-06-16 EP claimed
WO-2009083134-A1 METHOD FOR THE PRODUCTION OF 2-FLUOROACYL-3-AMINO-ACRYLIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-07-09 WO claimed
EP-2072497-A1 Method for manufacturing 2-fluoracyl-3-amino-acrylic acid derivatives Bayer CropScience AG (DE) 2009-06-24 EP claimed
WO-2009043444-A1 PROCESS FOR PREPARING 2-DIHALOACYL-3-AMINOACRYLIC ACID DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-04-09 WO claimed
EP-2042482-A1 Method for manufacturing 2-dihalogenacyl-3-amino-acrylic acid derivatives Bayer CropScience AG (DE) 2009-04-01 EP claimed
US-6706911-B1 REACTING N-SUBSTITUTED 3-AMINOACRYLIC ESTERS WITH HALOALKYLCARBOXYLIC ANHYDRIDES IN PRESENCE OF BASE; PYRAZOLE-4-CARBOXYLIC ACID CHEMICAL INTERMEDIATES; HALOACYLATION BAYER AKTIENGESELLSCHAFT (DE) 2004-03-16 US claimed
EP-0176846-B1 3-AMINO-2-BENZOYL-ACRYLIC-ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1989-08-16 EP claimed
CN-85101686-B 3-amino-2-benzoyl-acrylic acid derivative and a process for producing the same 拜尔公司 1988-12-14 CN claimed
EP-0176846-A2 3-Amino-2-benzoyl-acrylic-acid derivatives and process for their preparation BAYER AG (DE) 1986-04-09 EP claimed