SCHEMBL244227

SCHEMBL244227

CCC(C)(C)CC(C)C.N=C=O.N=C=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
SCHEMBL4614206 1.00
Methane SCHEMBL22973404 0.98
Isothiocyanate SCHEMBL22974988 0.86
SCHEMBL100229 0.84
Isothiocyanate SCHEMBL26666187 0.84
SCHEMBL810783 0.82
SCHEMBL11005686 0.79 TSHR (0.35)
SCHEMBL22973402 0.79
SCHEMBL1907966 0.77
SCHEMBL5276113 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 506 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240352172-A1 RADIATION CURABLE COMPOSITIONS FOR ADDITIVE MANUFACTURING OF PARTS WITH HIGH IMPACT RESISTANCE, HIGH DUCTILITY AND HIGH HEAT RESISTANCE EVONIK OPERATIONS GMBH (DE) 2024-10-24 US claimed
EP-4392258-A1 RADIATION CURABLE COMPOSITIONS FOR ADDITIVE MANUFACTURING OF PARTS WITH HIGH IMPACT RESISTANCE, HIGH DUCTILITY AND HIGH HEAT RESISTANCE Evonik Operations GmbH (DE) 2024-07-03 EP claimed
WO-2024099798-A1 RADIATION CURABLE COMPOSITIONS FOR ADDITIVE MANUFACTURING OF HIGH TOUGHNESS ARTICLES EVONIK OPERATIONS GMBH (DE) 2024-05-16 WO claimed
US-11898054-B2 Actinic radiation-curable urethane/urea-containing aerospace coatings and sealants PRC-DESOTO INTERNATIONAL, INC. (US) 2024-02-13 US claimed
US-20230407132-A1 (METH)ACRYLATE-FUNCTIONAL RADIATION CURABLE COMPOSITIONS FOR ADDITIVE FABRICATION COVESTRO (NETHERLANDS) B.V. (NL) 2023-12-21 US claimed
EP-4163314-B1 PROCESS FOR THE PREPARATION OF SOLID POLYURETHANE HARDENERS EVONIK OPERATIONS GMBH (DE) 2023-12-06 EP claimed
EP-4237175-A1 (METH)ACRYLATE-FUNCTIONAL RADIATION CURABLE COMPOSITIONS FOR ADDITIVE FABRICATION Covestro (Netherlands) B.V. (NL) 2023-09-06 EP claimed
EP-4163314-A1 PROCESS FOR THE PREPARATION OF SOLID POLYURETHANE HARDENERS Evonik Operations GmbH (DE) 2023-04-12 EP claimed
CN-115926107-A Method for preparing solid polyurethane curing agent 赢创运营有限公司 2023-04-07 CN claimed
US-20230105553-A1 PROCESS FOR PRODUCING SOLID POLYURETHANE CURING AGENTS EVONIK OPERATIONS GMBH (DE) 2023-04-06 US claimed
EP-2785761-B1 PROCESS FOR CONTINUOUS ISOCYANATE MODIFICATION COVESTRO DEUTSCHLAND AG (DE) 2017-09-13 EP claimed
US-20170008995-A1 PROCESS FOR ISOCYANATE MODIFICATION USING SPIROCYCLIC AMMONIUM SALTS AS CATALYST COVESTRO DEUTSCHLAND AG (DE) 2017-01-12 US claimed
US-20170008996-A1 METHOD FOR ISOCYANATE MODIFICATION USING CATALYSTS WITH AN NPN SEQUENCE COVESTRO DEUTSCHLAND AG (DE) 2017-01-12 US claimed
US-20140343280-A1 PROCESS FOR CONTINUOUS ISOCYANATE MODIFICATION COVESTRO DEUTSCHLAND AG (DE) 2014-11-20 US claimed
EP-1639987-B1 Dental adhesive composition 3M ESPE AG (DE) 2009-08-12 EP claimed
US-6837712-B2 Dental restorative compositions KERR CORPORATION (US) 2005-01-04 US claimed
EP-1393705-A1 Dental restorative compounds Kerr Corporation (US) 2004-03-03 EP claimed
US-20040039079-A1 Dental restorative compositions KERR CORPORATION 2004-02-26 US claimed
EP-0599223-A1 Self-lubricating abrasion resistant material and products DENTSPLY INTERNATIONAL, INC. (US) 1994-06-01 EP claimed
EP-0529264-A2 Self-lubricating abrasion resistant material and products for use in dentistry DENTSPLY INTERNATIONAL, INC. (US) 1993-03-03 EP claimed