SCHEMBL50317

SCHEMBL50317

CCCC(N=C=O)C(C)(N=C=O)C(C)(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
SCHEMBL4810914 0.82
SCHEMBL6549799 0.81
SCHEMBL25176249 0.76
SCHEMBL25170508 0.74 CA2 (0.31)
SCHEMBL7530155 0.74 CHRM1 (0.31)
SCHEMBL25170643 0.73 MAPT (0.32)
SCHEMBL25173775 0.71 MAPT (0.34)
SCHEMBL25176247 0.71 MAPT (0.34)
SCHEMBL25170599 0.71 MAPT (0.34)
SCHEMBL4806076 0.68

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 1331 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119979105-A Bi-component polyurethane adhesive for bonding composite materials and preparation method thereof 四川东树新材料有限公司 2025-05-13 CN claimed
CN-118580673-A Polyurethane composition for electrical insulation casting system and preparation method thereof 四川东树新材料有限公司 2024-09-03 CN claimed
US-20240228819-A1 WATER-BORNE COATING COMPOSITION, ITS PREPARATION METHOD AND APPLICATION THEREOF BASF COATINGS GMBH (DE) 2024-07-11 US claimed
CN-114805714-B Vacuum-introduced polyurethane system, FRP material and preparation method thereof 四川东树新材料有限公司 2024-02-23 CN claimed
CN-117440978-A Aqueous coating composition, preparation method and application thereof 巴斯夫涂料有限公司 2024-01-23 CN claimed
EP-4288443-A1 MODIFIED GUAYULE RESIN PRODUCT AND RELATED PROCESSES BRIDGESTONE CORPORATION (JP) 2023-12-13 EP claimed
EP-4163314-B1 PROCESS FOR THE PREPARATION OF SOLID POLYURETHANE HARDENERS EVONIK OPERATIONS GMBH (DE) 2023-12-06 EP claimed
EP-4274858-A1 A WATERBORNE POLYURETHANE-EPOXY RESIN BASED PRIMER COMPOSITION AND ITS PREPARATION METHOD THEREOF BASF Coatings GmbH (DE) 2023-11-15 EP claimed
CN-116323742-A Water-based polyurethane-epoxy resin base primer composition and preparation method thereof 巴斯夫涂料有限公司 2023-06-23 CN claimed
EP-4163314-A1 PROCESS FOR THE PREPARATION OF SOLID POLYURETHANE HARDENERS Evonik Operations GmbH (DE) 2023-04-12 EP claimed
US-20070111824-A1 Golf Ball Which Includes Fast-Chemical-Reaction-Produced Component and Method of Making Same OGIO INTERNATIONAL, INC. 2007-05-17 US claimed
CN-1871272-A Water-emulsifiable isocyanates having improved properties BASF AG (DE) 2006-11-29 CN claimed
CN-1865328-A Water dispersible end capping diisocyanate cross-linking agent and its preparation method GUANGZHOU INST OF CHEMISTRY (CN) 2006-11-22 CN claimed
WO-2006048166-A1 MICROCAPSULE DISPERSIONS BASF AKTIENGESELLSCHAFT (DE) 2006-05-11 WO claimed
CN-1230457-C Compound with isocyanate group, coating composition containing compound, preparation method and application of compound BASF AG (DE) 2005-12-07 CN claimed
US-20050239989-A1 Water emulsifable isocyanates having improved properties BASF AKTIENGESELLSCHAFT (DE) 2005-10-27 US claimed
US-20050107188-A1 Golf Ball which Includes Fast-Chemical-Reaction-Produced Component and Method of Making Same CALLAWAY GOLF COMPANY (US) 2005-05-19 US claimed
US-5776394-A Process for manufacturing cellulose fibres BASF AKTIENGESELLSCHAFT (DE) 1998-07-07 US claimed
EP-0486881-B1 Non-aqueous polyisocyanate composition BASF AG (DE) 1997-02-05 EP claimed
US-5387367-A Storage stability; polyetherurethane copolymer BASF AKTIENGESELLSCHAFT (DE) 1995-02-07 US claimed