⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tert-Butanol SCHEMBL452899 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL27552235 | 0.94 | ALDH1A1 (0.39) | — | |
| Tert-Butanol SCHEMBL27849026 | 0.94 | — | — | |
| Tert-Butanol SCHEMBL20503401 | 0.93 | ALDH1A1 (0.46) | — | |
| Tert-Butanol SCHEMBL3628777 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL788666 | 0.93 | ALDH1A1 (0.46) | — | |
| Tert-Butanol SCHEMBL282 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL10811644 | 0.88 | — | — | |
| Tert-Butanol SCHEMBL28145416 | 0.88 | — | — | |
| Tert-Butanol SCHEMBL28254078 | 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 1624 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250320221-A1 | NOVEL INTERMEDIATE, METHOD FOR PREPARING THE SAME AND APPLICATION THEREOF | UNIV SICHUAN (CN) | 2025-10-16 | — | — | US | claimed |
| CN-117954722-A | Method for synchronously realizing repair and surface coating of waste lithium ion battery positive electrode material regeneration | 中南大学 | 2024-04-30 | — | — | CN | claimed |
| WO-2023190767-A1 | POLYETHER ETHER KETONE DECOMPOSITION METHOD AND NOVEL SUBSTANCE USING STARTING MATERIAL THAT IS DECOMPOSITION PRODUCT OBTAINED BY THIS DECOMPOSITION METHOD | 国立研究開発法人産業技術総合研究所 | 2023-10-05 | — | — | WO | claimed |
| EP-4201926-A1 | NOVEL INTERMEDIATE, PREPARATION METHOD FOR SAME, AND APPLICATIONS THEREOF | Sichuan University (CN) | 2023-06-28 | — | — | EP | claimed |
| CN-115925647-A | Production method of linezolid | 湖北广济药业股份有限公司 | 2023-04-07 | — | — | CN | claimed |
| US-20210230371-A1 | METHOD FOR PREPARING ALIPHATIC POLYTHIOETHER | UNIV ZHEJIANG (CN) | 2021-07-29 | — | — | US | claimed |
| EP-3818038-A1 | PROCESS FOR THE PRODUCTION OF ARYLAMINES | Merck Patent GmbH (DE) | 2021-05-12 | — | — | EP | claimed |
| WO-2021083018-A1 | PREPARATION METHOD FOR AND APPLICATION OF 3-SUBSTITUTED CHIRAL SPIRO AMINOPHOSPHINE LIGAND ON PYRIDINE RING | 浙江九洲药业股份有限公司 | 2021-05-06 | — | — | WO | claimed |
| WO-2020007770-A1 | PROCESS FOR THE PRODUCTION OF ARYLAMINES | MERCK PATENT GMBH (DE) | 2020-01-09 | — | — | WO | claimed |
| CN-110498773-A | A kind of acetylenic acid synthesis 1,4- replaces the method for 1,2,3- triazole | UNIV LESHAN NORMAL | 2019-11-26 | — | — | CN | claimed |
| CN-1149192-C | Process for preparing protected 4-aminomethylpyrrolidin-3-ones | ��ʽ����LG������ѧ | 2004-05-12 | — | — | CN | claimed |
| CN-1481385-A | Process for formulation of antibiotic compounds | — | 2004-03-10 | — | — | CN | claimed |
| CN-1108328-C | Synthetizing of poly-p-phenylacetylene | INST OF MILITARY MEDICINE LOGI (CN) | 2003-05-14 | — | — | CN | claimed |
| CN-1411454-A | Method for preparation of citalopram | LUNDBECK & CO AS H (DK) | 2003-04-16 | — | — | CN | claimed |
| CN-1356317-A | Process for producing retinol and intermediate compound for producing retinol | SUMITOMO CHEMICAL CO (JP) | 2002-07-03 | — | — | CN | claimed |
| CN-1296473-A | Convergent synthesis of alpha-aryl-beta-ketonitriles | DU PONT PHARM CO (US) | 2001-05-23 | — | — | CN | claimed |
| CN-1291975-A | Process for preparing protected 4-aminomethylpyrrolidin-3-ones | LG CHEMICAL LTD (KR) | 2001-04-18 | — | — | CN | claimed |
| CN-1268121-A | Crystalline 10,10-bis ((2-fluoro-4-pyridinyl) methyl)-9 (10H)-anthraclnone and an improved process for preparing the same | DU PONT PHARM CO (US) | 2000-09-27 | — | — | CN | claimed |
| CN-1264387-A | Nucleotide analogue-containing composition and synthesis method thereof | GILEAD SCIENCES INC (US) | 2000-08-23 | — | — | CN | claimed |
| WO-1993010076-A1 | SYNTHESIS AND OPTICAL RESOLUTION OF THE TAXOL SIDE CHAIN AND RELATED COMPOUNDS | THE UNIVERSITY OF MISSISSIPPI (US) | 1993-05-27 | — | — | WO | claimed |