SCHEMBL10170029

SCHEMBL10170029

CC(=O)C(I)C(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
SCHEMBL2550754 0.82
SCHEMBL9494577 0.78
Hydrochloric Acid SCHEMBL29057364 0.77
SCHEMBL18098640 0.75
SCHEMBL11465803 0.75
SCHEMBL11391386 0.72
SCHEMBL16494976 0.72
SCHEMBL28673530 0.72
SCHEMBL14878716 0.72
Acetone SCHEMBL27671158 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025090988-A1 METHODS FOR PRODUCING SMALL HALOGENATED COMPOUNDS FROM PEROXY ACIDS BIGELOW LABORATORY FOR OCEAN SCIENCES (US) 2025-05-01 WO disclosed
WO-2025090983-A1 TREATMENT OF ORGANIC PRODUCTS FOR PRODUCTION OF SMALL HALOGENATED ORGANIC COMPOUNDS BIGELOW LABORATORY FOR OCEAN SCIENCES (US) 2025-05-01 WO disclosed
EP-3434681-B1 CURCUMIN-BORON COMPLEX AND PHARMACEUTICAL CONTAINING SAME JAPAN SCIENCE & TECH AGENCY (JP) 2023-05-10 EP disclosed
CN-115304573-A Synthetic method of 4-aromatic ether coumarin derivative 山东达冠医药科技有限公司 2022-11-08 CN disclosed
CN-108884112-B Curcumin boron complex and medicine containing curcumin boron complex 国立研究开发法人科学技术振兴机构 2021-03-02 CN disclosed
US-10669287-B2 Curcumin-boron complex and pharmaceutical containing same JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2020-06-02 US disclosed
US-10626128-B2 2020-04-21 US disclosed
US-20190100537-A1 CURCUMIN-BORON COMPLEX AND PHARMACEUTICAL CONTAINING SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2019-04-04 US disclosed
EP-3434681-A1 CURCUMIN-BORON COMPLEX AND PHARMACEUTICAL CONTAINING SAME Japan Science and Technology Agency (JP) 2019-01-30 EP disclosed
US-20120028979-A1 2-(PIPERIDIN-1-YL)-4-HETEROCYCLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-02-02 US disclosed