SCHEMBL628602

SCHEMBL628602

CCC#CCBr

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
Bromide SCHEMBL17419779 0.96
SCHEMBL14964623 0.90
SCHEMBL3459658 0.90
SCHEMBL12621545 0.90
SCHEMBL16232226 0.90
SCHEMBL1806722 0.85
SCHEMBL846055 0.78
SCHEMBL1894280 0.78
SCHEMBL7109 0.78
SCHEMBL31122211 0.74 ALDH1A1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271290-A Continuous flow preparation method of trithio s-triazine compound 上海沃凯生物技术有限公司 2024-07-02 CN claimed
CN-117898291-A Poplar plutella xylostella sex pheromone antagonist and application thereof 中国林业科学研究院森林生态环境与自然保护研究所(国家林业和草原局世界自然遗产保护研究中心) 2024-04-19 CN claimed
CN-115490589-B Synthesis method of sex attractant for potato tuber moth 贵州大学 2024-02-09 CN claimed
CN-117304151-A Novel synthesis method of jasmine lactone 安徽华业香料合肥有限公司 2023-12-29 CN claimed
CN-110156735-B Formononetin derivative and preparation method and application thereof 天津国际生物医药联合研究院 2023-05-12 CN claimed
CN-115490589-A Method for synthesizing potato tuber moth sex attractant 贵州大学 2022-12-20 CN claimed
CN-110156735-A Formononetin derivative and its preparation method and application 天津国际生物医药联合研究院 2019-08-23 CN claimed
EP-3049072-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS William Marsh Rice University (US) 2016-08-03 EP claimed
WO-2015048268-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS WILLIAM MARSH RICE UNIVERSITY (US) 2015-04-02 WO claimed
US-3941828-A Process for the preparation of cyclic ketones FIRMENICH SA (CH) 1976-03-02 US claimed
JP-8092150-A None JP disclosed
EP-4737503-A1 METHOD FOR PRODUCING POLYETHER COMPOUND, METHOD FOR PRODUCING POLYETHER COMPOUND HAVING REACTIVE SILICON GROUP, METHOD FOR PRODUCING POLYETHER COMPOUND HAVING URETHANE BOND, AND METHOD FOR PRODUCING POLYETHER COMPOUND HAVING POLYMERIZABLE UNSATURATED GROUP AGC INC. (JP) 2026-05-06 EP disclosed
EP-4737502-A1 METHOD FOR PRODUCING POLYETHER COMPOUND, METHOD FOR PRODUCING POLYETHER COMPOUND HAVING REACTIVE SILICON GROUP, METHOD FOR PRODUCING POLYETHER COMPOUND HAVING URETHANE BOND, AND METHOD FOR PRODUCING POLYETHER COMPOUND HAVING POLYMERIZABLE UNSATURATED GROUP AGC INC. (JP) 2026-05-06 EP disclosed
US-20260117023-A1 METHOD OF PRODUCING POLYETHER COMPOUND, METHOD OF PRODUCING POLYETHER COMPOUND CONTAINING REACTIVE SILICON GROUP, METHOD OF PRODUCING POLYETHER COMPOUND HAVING URETHANE BOND, AND METHOD OF PRODUCING POLYETHER COMPOUND CONTAINING POLYMERIZABLE UNSATURATED GROUP AGC Inc. (JP) 2026-04-30 US disclosed
US-20260109814-A1 METHOD OF PRODUCING POLYETHER COMPOUND, METHOD OF PRODUCING POLYETHER COMPOUND CONTAINING REACTIVE SILICON GROUP, METHOD OF PRODUCING POLYETHER COMPOUND HAVING URETHANE BOND, AND METHOD OF PRODUCING POLYETHER COMPOUND CONTAINING POLYMERIZABLE UNSATURATED GROUP AGC Inc. (JP) 2026-04-23 US disclosed
US-4002640-A ANTIFUNGAL AGENTS SYNTEX (U.S.A.) INC. (US) 1977-01-11 US disclosed
US-3970671-A XANTHENE, PRESSURE SENSITIVE KANZAKI PAPER MANUFACTURING CO., LTD. (JA) 1976-07-20 US disclosed
US-3957833-A KILLING INSECTS, HORMONES HOFFMANN-LA ROCHE INC. (US) 1976-05-18 US disclosed
US-3947471-A CHROMOGENIC SUMITOMO CHEMICAL COMPANY, LTD. (JA) 1976-03-30 US disclosed
US-3941828-A Process for the preparation of cyclic ketones FIRMENICH SA (CH) 1976-03-02 US disclosed