SCHEMBL789340

SCHEMBL789340

CC(C)(O)C(C)(C)O.[B]

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
SCHEMBL3230777 1.00 THRB (0.50)
SCHEMBL30236594 1.00 THRB (0.50)
SCHEMBL1163579 1.00 THRB (0.50)
SCHEMBL29426245 1.00 THRB (0.50)
SCHEMBL30600321 0.94 THRB (0.46)
SCHEMBL504018 0.94 THRB (0.55)
SCHEMBL8968 0.94
SCHEMBL27028519 0.94 THRB (0.55)
SCHEMBL402114 0.88 THRB (0.50)
SCHEMBL129302 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114555077-B Patentiflorin A analogs as antiviral agents 香港浸会大学 2025-01-24 CN claimed
CN-115536681-B Method for selectively synthesizing p-pinacol boron ester substituted anisole compound 广西科学院 2024-12-24 CN claimed
CN-118994217-A Purification method and application of alkenyl gem-diboron ester and photodegradable vinyl polymer 北京大学 2024-11-22 CN claimed
CN-118955527-A APD seven-membered ring derivative and preparation method and application thereof 南开大学 2024-11-15 CN claimed
CN-118255785-A Chiral AIEgens of cinchona alkaloid amide skeleton, preparation method and application 宝鸡文理学院 2024-06-28 CN claimed
CN-118125989-A Method for synthesizing triphenylene derivative containing triazine structure 棓诺(苏州)新材料有限公司 2024-06-04 CN claimed
CN-116396293-A AIE type luminescent material and preparation method thereof 扬州工业职业技术学院 2023-07-07 CN claimed
CN-112661653-B Method for preparing amine by catalytic reduction of nitro compound by using cyclic (alkyl) (amino) carbene chromium complex 四川大学 2023-05-26 CN claimed
CN-112125770-B Silicon-center chiral dihydrobenzothiole and preparation method thereof 南方科技大学 2023-01-03 CN claimed
CN-115536681-A Method for selectively synthesizing para-frequency boroester substituted anisole compound 广西科学院 2022-12-30 CN claimed
CN-108342192-B A kind of double boron fluorescent materials and preparation method thereof, OLED device 北京大学深圳研究生院 2019-11-26 CN claimed
CN-110357912-A Three silicon amine rare earth compoundings prepare the application in aminated compounds in catalysis nitrile and borine reaction 苏州大学 2019-10-22 CN claimed
CN-109651082-A The method that room temperature prepares aliphatic alcohol 苏州大学 2019-04-19 CN claimed
CN-108358793-A A kind of secondary-amine compound synthesized by alkynes and its synthetic method 三峡大学 2018-08-03 CN claimed
CN-108342192-A A kind of double boron fluorescent materials and preparation method thereof, OLED device 北京大学深圳研究生院 2018-07-31 CN claimed
CN-108299480-A A kind of preparation method of Ao Zesha stars and its intermediate 山东百诺医药股份有限公司 2018-07-20 CN claimed
CN-106188119-B Application of bis (β -diimine) rare earth amide in catalysis of hydroboration reaction of ketone and borane 苏州大学 2018-06-12 CN claimed
CN-105585692-A Organic porous polymer material and preparation method thereof UNIV HUAZHONG SCIENCE TECH 2016-05-18 CN claimed
EP-4568746-B1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2026-04-29 EP disclosed
CN-101528716-A Compounds and methods for inhibiting the interaction of BCL proteins with binding partners INFINITY DISCOVERY INC (US) 2009-09-09 CN disclosed