SCHEMBL20528323

SCHEMBL20528323

C1CCC1.CC1=C(N=C=O)C=CC(C)(N=C=O)C1

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
SCHEMBL153964 0.97
SCHEMBL19858904 0.82
SCHEMBL21061438 0.75
SCHEMBL3688264 0.74 ALDH1A1 (0.60)
SCHEMBL224353 0.68
SCHEMBL28891517 0.65
SCHEMBL7176093 0.65
SCHEMBL4455086 0.62 GABRA1 (0.30)
SCHEMBL11742467 0.60
SCHEMBL28541421 0.60

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113980289-B Nitrogen and phosphorus-containing lignin-based flame retardant, preparation method and application thereof 长春工业大学 2024-01-26 CN claimed
CN-114369219-B Polyurea particle modified thixotropic resin and preparation method thereof 上海金仕迈树脂有限公司 2023-11-10 CN claimed
CN-109776749-A A kind of lignin-base flexible electromagnetic shielding material 长春工业大学 2019-05-21 CN claimed
CN-107245138-A A kind of preparation of lignin-base fire retardant and its application process 长春工业大学 2017-10-13 CN claimed
CN-107141437-A A kind of thermoplastic polyurethane material of controllable crystallization and preparation method thereof 万华化学集团股份有限公司 2017-09-08 CN claimed
CN-103073876-B Preparation method of aromatic high solid content water-borne polyurethane DYMATIC BSD CO LTD 2015-05-27 CN claimed
CN-119410133-A Polyurethane-polyamide copolymerized elastomer composition, preparation method and application thereof 万华化学集团股份有限公司 2025-02-11 CN disclosed
US-12084555-B2 Porous materials for energy management NANO AND ADVANCED MATERIALS INSTITUTE LIMITED (CN) 2024-09-10 US disclosed
CN-113980289-B Nitrogen and phosphorus-containing lignin-based flame retardant, preparation method and application thereof 长春工业大学 2024-01-26 CN disclosed
US-20220169812-A1 POROUS MATERIALS FOR ENERGY MANAGEMENT NANO AND ADVANCED MATERIALS INSTITUTE LIMITED (CN) 2022-06-02 US disclosed
US-11286328-B2 Thermoplastic polyurethane elastomer, and preparation method, use and product thereof WANHUA CHEMICAL GROUP CO., LTD. 2022-03-29 US disclosed
CN-106674471-B A kind of thermoplastic polyurethane elastomer and preparation method thereof, purposes and product 万华化学集团股份有限公司 2019-09-03 CN disclosed
US-20180291141-A1 THERMOPLASTIC POLYURETHANE ELASTOMER, AND PREPARATION METHOD, USE AND PRODUCT THEREOF WANHUA CHEMICAL GROUP CO., LTD. (CN) 2018-10-11 US disclosed
CN-106674471-A Thermoplastic polyurethane elastomer and preparation method, application and product thereof 万华化学集团股份有限公司 2017-05-17 CN disclosed
CN-103073876-B Preparation method of aromatic high solid content water-borne polyurethane DYMATIC BSD CO LTD 2015-05-27 CN disclosed