⚠ 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 SCHEMBL3628777 | 1.00 | — | — | |
| Tert-Butanol SCHEMBL788666 | 1.00 | ALDH1A1 (0.46) | — | |
| Tert-Butanol SCHEMBL20503401 | 1.00 | ALDH1A1 (0.46) | — | |
| Tert-Butanol SCHEMBL10864527 | 0.93 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL21268474 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL25297067 | 0.93 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL183182 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL1794621 | 0.93 | — | — | |
| Tert-Butanol SCHEMBL8915084 | 0.93 | ALDH1A1 (0.42) | — | |
| Tert-Butanol SCHEMBL16552604 | 0.93 | — | — |
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 483263 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024212883-A1 | PREPARATION METHOD FOR ARYL METHOXY ISOINDOLINE DERIVATIVE | 上海科胜药物研发有限公司 | 2024-10-17 | — | — | WO | claimed |
| WO-2024213503-A1 | PROCESS FOR PREPARING ESTERAMIDE COMPOUNDS | SPECIALTY OPERATIONS FRANCE (FR) | 2024-10-17 | — | — | WO | claimed |
| WO-2024213474-A1 | PROCESSES FOR PRODUCING ALKYL ACRYLATE DIMERS | SPECIALTY OPERATIONS FRANCE (FR) | 2024-10-17 | — | — | WO | claimed |
| WO-2024201231-A1 | A PROCESS FOR THE PREPARATION OF ISOXAZOLINE-SUBSTITUTED AMIDE COMPOUNDS AND ITS INTERMEDIATES THEREOF | HIKAL LIMITED (IN) | 2024-10-03 | — | — | WO | claimed |
| CN-118724723-A | Green synthesis method of nitrobenzene compounds | 清源创新实验室 | 2024-10-01 | — | — | CN | claimed |
| CN-118271603-B | Polyaniline nanoparticle and preparation method thereof | 广东腐蚀科学与技术创新研究院 | 2024-09-24 | — | — | CN | claimed |
| CN-114085185-B | Method for preparing bedaquiline and pharmaceutically acceptable salts thereof | 东亚ST 株式会社 | 2024-09-24 | — | — | CN | claimed |
| CN-118684629-A | Icotide preparation method of factor | 甘肃瑞德林生物有限公司 | 2024-09-24 | — | — | CN | claimed |
| WO-2024190907-A1 | PRODUCTION METHODS FOR 2'-O-MODIFIED ADENOSINE PHOSPHORAMIDITE AND INTERMEDIATE THEREOF | 日産化学株式会社 | 2024-09-19 | — | — | WO | claimed |
| EP-3996701-B1 | A PROCESS FOR ISOLATING S-ISOMER CRYSTALS OF INDOXACARB | GHARDA CHEMICALS LTD (IN) | 2024-09-18 | — | — | EP | claimed |
| US-3949001-A | Process for producing aryl alpha-haloalkyl sulfones | SOUTHERN ILLINOIS UNIVERSITY FOUNDATION (US) | 1976-04-06 | — | — | US | claimed |
| US-3948989-A | N-monosubstituted amide production | PHILLIPS PETROLEUM COMPANY (US) | 1976-04-06 | — | — | US | claimed |
| US-3941770-A | Method for purifying 3',5'-cyclic-adenylic acid or 3',5'-cyclic-deoxyadenylic acid | KIKKOMAN SHOYU CO., LTD. (JA) | 1976-03-02 | — | — | US | claimed |
| US-3940548-A | Surface treatment of rubber articles with an alkyl hypohalite | NIPPON ZLIN CO. LTD. (JA) | 1976-02-24 | — | — | US | claimed |
| US-3940374-A | Synthesis of polythiol polymer intermediates from polyunsaturated hydrocarbons | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1976-02-24 | — | — | US | claimed |
| US-3939110-A | Aqueous polyelectrolytic electrocoating materials of organic resins | AMERICAN CAN COMPANY (US) | 1976-02-17 | — | — | US | claimed |
| US-3936452-A | Process of producing pyrimidyl thiocarbonates | NITTO BOSEKI CO., LTD. (JA) | 1976-02-03 | — | — | US | claimed |
| US-3932375-A | PROTECTING GROUPS | NITTO BOSEKI CO. LTD. (JA) | 1976-01-13 | — | — | US | claimed |
| US-3931044-A | METHOD FOR RECOVERING MOLYBDENUM CATALYST VALUES AND USE OF SAID VALUES IN THE RECYCLING OF SAID CATALYST | COMPAGNIE FRANCAISE DE RAFFINAGE (FR) | 1976-01-06 | — | — | US | claimed |
| US-3931323-A | Process for the preparation of alkenoyl-substituted cyclohexenes | FIRMENICH SA (CH) | 1976-01-06 | — | — | US | claimed |