SCHEMBL223546

SCHEMBL223546

CC(C)(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
SCHEMBL2439671 1.00
Chloromethane SCHEMBL17457033 0.84
Tert-Butanol SCHEMBL11746210 0.82 ALDH1A1 (0.35)
Tert-Butylamine SCHEMBL760575 0.82
Ethane SCHEMBL333142 0.78 TSHR (0.42)
Ethane SCHEMBL2248986 0.78 TSHR (0.42)
Ethane SCHEMBL6302671 0.78 TSHR (0.42)
Ethane SCHEMBL690547 0.78
Ethane SCHEMBL5283872 0.78
Ethane SCHEMBL6481482 0.78 TSHR (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12509419-B2 Process for the distillation of isocyanates COVESTRO DEUTSCHLAND AG (DE) 2025-12-30 US claimed
CN-114423736-B Method for distilling isocyanates 科思创德国股份有限公司 2025-02-18 CN claimed
EP-4163314-B1 PROCESS FOR THE PREPARATION OF SOLID POLYURETHANE HARDENERS EVONIK OPERATIONS GMBH (DE) 2023-12-06 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
US-20220380303-A1 PROCESS FOR THE DISTILLATION OF ISOCYANATES COVESTRO DEUTSCHLAND AG (DE) 2022-12-01 US claimed
EP-4038049-A1 PROCESS FOR THE DISTILLATION OF ISOCYANATES Covestro Intellectual Property GmbH & Co. KG (DE) 2022-08-10 EP claimed
CN-114423736-A Method for distilling isocyanates 科思创知识产权两合公司 2022-04-29 CN claimed
CN-110483980-B Composite electromagnetic shielding material and preparation method and application thereof 东北师范大学 2021-05-25 CN claimed
WO-2021063760-A1 PROCESS FOR THE DISTILLATION OF ISOCYANATES COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2021-04-08 WO claimed
CN-107353863-B Modified polyurethane adhesive for dry-cleaning-resistant reflective material 浙江夜光明光电科技股份有限公司 2020-08-11 CN claimed
CN-110483980-A A kind of composite electromagnetic shield materials and its preparation method and application UNIV NORTHEAST 2019-11-22 CN claimed
CN-107353863-A A kind of resistance to dry-cleaning reflectorized material modified polyurethane adhesive 浙江夜光明光电科技股份有限公司 2017-11-17 CN claimed
US-12509419-B2 Process for the distillation of isocyanates COVESTRO DEUTSCHLAND AG (DE) 2025-12-30 US disclosed
CN-114423736-B Method for distilling isocyanates 科思创德国股份有限公司 2025-02-18 CN disclosed
US-12152102-B2 Process for producing solid polyurethane curing agents EVONIK OPERATIONS GMBH (DE) 2024-11-26 US disclosed
US-6465539-B1 DRY SURFACES FROM ULTRAVIOLET LIGHT CURED METHACRYLATED URETHANE, POLYOL AND OPTIONALLY ADDITIONAL POLYISOCYANATES; FLEXURALLY STRONG COATED PLASTICS BAYER AKTIENGESELLSCHAFT (DE) 2002-10-15 US disclosed
US-5717091-A CROSSLINKED HARD COATING BAYER AKTIENGESELLSCHAFT (DE) 1998-02-10 US disclosed
US-5145745-A Anionic polyurethane KONICA CORPORATION (JP) 1992-09-08 US disclosed