SCHEMBL21342

SCHEMBL21342

[CH2]COC(C)(C)C

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
SCHEMBL291840 0.79
SCHEMBL8194157 0.74
SCHEMBL4889593 0.72
SCHEMBL7859448 0.72
SCHEMBL854259 0.72
SCHEMBL235300 0.72
SCHEMBL4891160 0.70
SCHEMBL3295226 0.69
SCHEMBL4075639 0.69
SCHEMBL3978359 0.69

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

Appears in 4119 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024128572-A1 HYBRID METALLOCENE CATALYST, AND METHOD FOR PREPARING POLYETHYLENE BY USING SAME 주식회사 엘지화학 2024-06-20 WO claimed
WO-2024102986-A2 SARS-COV-2 MPRO INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM (US) 2024-05-16 WO claimed
CN-116926558-A Oxyether xanthate metal corrosion inhibitor and preparation method and application thereof 湖南新文锋智能装备有限公司 2023-10-24 CN claimed
CN-116926557-A Acyl thiourea metal corrosion inhibitor and preparation method and application thereof 湖南新文锋智能装备有限公司 2023-10-24 CN claimed
CN-113210134-B Preparation and application of acyl carboxyl azothioic ester compound 湖南科技大学 2022-06-14 CN claimed
CN-114516815-A Controllable defluorination deuteration method for polyfluoroamide 中国科学技术大学 2022-05-20 CN claimed
US-20220135557-A1 RET INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-05-05 US claimed
US-20220119382-A1 RET INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2022-04-21 US claimed
CN-110062757-B Factor XIa inhibitors and uses thereof 广东东阳光药业有限公司 2022-03-04 CN claimed
CN-113874375-A Cyclic amide compounds and methods thereof for the treatment of rabies 株式会社大分大学先端医学研究所 2021-12-31 CN claimed
EP-0101023-B1 PROCESS FOR PREPARING 2-CARBAMOYLOXYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND INTERMEDIATES USEFUL FOR THE PROCESS BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-07-29 EP claimed
EP-0229779-A1 ORTHOPEDIC CAST SYSTEM ISOPEDIX CORPORATION (US) 1987-07-29 EP claimed
WO-1986007533-A1 ORTHOPEDIC CAST SYSTEM ISOPEDIX CORPORATION (US) 1986-12-31 WO claimed
EP-0101023-A1 Process for preparing 2-carbamoyloxyalkyl-1,4-dihydropyridine derivatives and intermediates useful for the process BANYU PHARMACEUTICAL CO., LTD. (JP) 1984-02-22 EP claimed
EP-0019700-B1 PROCESS FOR THE PREPARATION OF PHOSPHORCHLORIDE THIOLATES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1983-06-08 EP claimed
EP-0063747-A1 2-Substituted or unsubstituted aminocarbonyloxyalkyl-1,4-dihydropyridines BANYU PHARMACEUTICAL CO., LTD. (JP) 1982-11-03 EP claimed
US-4290978-A Production of phosphoro chloride thiolates NIHON TOKUSHU NOYASU SEIZO K.K. (JP) 1981-09-22 US claimed
US-4252716-A BLUE SHADES BAYER AKTIENGESELLSCHAFT (DE) 1981-02-24 US claimed
EP-0019700-A2 Process for the preparation of phosphorchloride thiolates NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1980-12-10 EP claimed
US-3991042-A Basic azo dyestuffs containing a benzthiazole and a tetrahydroquinoline nucleus BAYER AKTIENGESELLSCHAFT (DT) 1976-11-09 US claimed