SCHEMBL16469722

SCHEMBL16469722

NC(=O)C1COCO1

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
SCHEMBL7525914 0.81
SCHEMBL7519504 0.81
SCHEMBL33498 0.81
SCHEMBL10754954 0.78 PARP1 (0.33)
SCHEMBL840269 0.78
SCHEMBL4640334 0.78
SCHEMBL1029023 0.77
SCHEMBL19550942 0.77
SCHEMBL10755272 0.77
Hydrochloric Acid SCHEMBL1291117 0.76 KDM4E (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113891879-A 3, 6-disubstituted-2-pyridine aldoxime skeletons 国家科学研究中心 2022-01-04 CN claimed
CN-113891879-B 3, 6-Disubstituted-2-pyridine aldoxime skeleton 国家科学研究中心 2025-03-04 CN disclosed
CN-119552094-A HDAC inhibitors, methods of making and uses thereof 安徽中医药大学 2025-03-04 CN disclosed
CN-113845439-B Bisbenzylamide CXCR4 antagonist and preparation and application thereof 杭州师范大学 2024-02-09 CN disclosed
CN-115710287-B Ring-opening boronation reaction method for cyclopropane compound under no metal catalysis 中国科学院兰州化学物理研究所 2024-01-09 CN disclosed
CN-109415334-B Process for producing 1, 3-dioxane-5-ones 花王株式会社 2023-12-08 CN disclosed
WO-2023217018-A1 EZH2 INHIBITOR AND USE THEREOF IN MEDICINE 贝达药业股份有限公司 2023-11-16 WO disclosed
CN-116730995-A Hydrazide compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-09-12 CN disclosed
CN-115710287-A Ring-opening boronization reaction method of cyclopropane compound under condition of no metal catalysis 中国科学院兰州化学物理研究所 2023-02-24 CN disclosed
CN-113891879-A 3, 6-disubstituted-2-pyridine aldoxime skeletons 国家科学研究中心 2022-01-04 CN disclosed
CN-110191722-A Pharmaceutical composition for treating HTLV-1 related myelopathy 第一三共株式会社 2019-08-30 CN disclosed
CN-109988199-A Rhodioside derivative and application thereof 上海华汇拓医药科技有限公司 2019-07-09 CN disclosed
US-9309218-B2 2-Oxo-1,3-dioxolane-4-carboxamides, their preparation and use CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2016-04-12 US disclosed
US-20150051365-A1 2-OXO-1,3-DIOXOLANE-4-CARBOXAMIDES, THEIR PREPARATION AND USE SIKA TECHNOLOGY AG (CH) 2015-02-19 US disclosed
CN-102442970-A Thiazole compounds as cannabinoid receptor ligands and uses thereof ABBOTT LAB 2012-05-09 CN disclosed
CN-101454302-A Thiazole compounds as cannabinoid receptor ligands and uses thereof ABBOTT LAB (US) 2009-06-10 CN disclosed
CN-1166678-C Purine derivatives ������ҩ�����޹�˾ 2004-09-15 CN disclosed
CN-1400975-A Purine derivatives PFIZER LTD (US) 2003-03-05 CN disclosed
CN-1378551-A Purine derivatives PFIZER LTD (US) 2002-11-06 CN disclosed