SCHEMBL410451

SCHEMBL410451

CC(=O)OC(C)I

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
SCHEMBL17266192 1.00
SCHEMBL10340745 0.78 TSHR (0.48)
SCHEMBL3815702 0.78 TSHR (0.38)
SCHEMBL28881912 0.78 TSHR (0.53)
SCHEMBL21811900 0.77
SCHEMBL3815710 0.75
SCHEMBL11467661 0.75
SCHEMBL21064874 0.73 TSHR (1.00)
SCHEMBL17751390 0.73 TSHR (0.65)
SCHEMBL10239103 0.73 TSHR (0.65)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117623922-A Preparation method and application of 1, 1-ethylene glycol diacetate 河北鼎泰制药有限公司 2024-03-01 CN claimed
CN-115806484-A Geosmin modifier and synthesis method thereof 苏州科铭生物技术有限公司 2023-03-17 CN claimed
CN-115572306-A Synthesis method of novel silane coupling agent trioxy-triethoxy-iminodiacetic acid diethyl ester organosilane 江苏省计量科学研究院(江苏省能源计量数据中心) 2023-01-06 CN claimed
CN-119330873-A In itramod Process for the preparation of intermediates 成都克莱蒙医药科技有限公司 2025-01-21 CN disclosed
EP-4460330-A1 CONJUGATES, COMPOSITIONS AND METHODS OF USE Virtuoso Binco, Inc. (US) 2024-11-13 EP disclosed
US-20240150293-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS VERNALIS (R&D) LTD (GB) 2024-05-09 US disclosed
CN-117623922-A Preparation method and application of 1, 1-ethylene glycol diacetate 河北鼎泰制药有限公司 2024-03-01 CN disclosed
CN-114746394-B Aryl propionic acid derivative, pharmaceutical composition, and preparation method and application thereof 南京海融医药科技股份有限公司 2024-02-02 CN disclosed
EP-4277892-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS Les Laboratoires Servier (FR) 2023-11-22 EP disclosed
CN-116940552-A Spirocyclic hexane derivatives, pharmaceutical compositions containing them and their use as anti-apoptotic inhibitors 法国施维雅药厂 2023-10-24 CN disclosed
US-20230241034-A1 MICROTUBULE POLYMERIZATION INHIBITOR PRODRUGS AND METHODS OF USING THE SAME UNIV MARYLAND (US) 2023-08-03 US disclosed
US-4839351-A Antibacterial compounds, and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-06-13 US disclosed
US-4687867-A Metallotetradecadiene compounds PHILLIPS PETROLEUM COMPANY (US) 1987-08-18 US disclosed
EP-0225634-A2 Antibacterial compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1987-06-16 EP disclosed
EP-0195342-A2 Preparation of gossyplureand 1-Metallo-5,9-tetradecadiene PHILLIPS PETROLEUM COMPANY (US) 1986-09-24 EP disclosed
US-4613614-A Prostaglandin I2 ester and fat emulsion containing the same THE GREEN CROSS CORPORATION (JP) 1986-09-23 US disclosed
US-4609498-A FROM 1,5-CYCLOOCTADIENE AND 1-HEXENE PHILLIPS PETROLEUM COMPANY (US) 1986-09-02 US disclosed
US-4357331-A 7αMethoxycephalosporin derivatives MEIJI SEIKA KAISHA, LTD. (JP) 1982-11-02 US disclosed
US-4325951-A 1-Oxadethiacephalosporin derivatives and antibacterial use thereof MEIJI SEIKA KAISHA, LTD. (JP) 1982-04-20 US disclosed
US-4321231-A IN TH PRESENCE OF AN ACID, USING A TELLURIUM OR SELENIUM COMPOUND ATLANTIC RICHFIELD COMPANY (US) 1982-03-23 US disclosed