⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7542023 | 1.00 | — | — | |
| Water SCHEMBL9827477 | 0.97 | KDM1A (0.48) | — | |
| Bicarbonate SCHEMBL28331597 | 0.95 | KDM1A (0.52) | — | |
| SCHEMBL290187 | 0.92 | PAOX (0.48) | — | |
| SCHEMBL716506 | 0.91 | BLM (0.57) | — | |
| SCHEMBL7942967 | 0.91 | BLM (0.57) | — | |
| SCHEMBL7944875 | 0.91 | BLM (0.57) | — | |
| SCHEMBL6822195 | 0.91 | BLM (0.57) | — | |
| SCHEMBL117939 | 0.91 | BLM (0.57) | — | |
| SCHEMBL8908184 | 0.91 | BLM (0.57) | — |
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 890 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121699809-B | Paenibacillus pretty girl and application thereof | Suzhou Institute of Technology (CN) | 2026-05-26 | — | — | CN | claimed |
| US-12618844-B2 | Cancer | IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) | 2026-05-05 | — | — | US | claimed |
| WO-2025150071-A1 | A TERNARY INSECTICIDAL COMPOSITION FOR INSECTS, PESTS AND MITES | RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) | 2025-07-17 | — | — | WO | claimed |
| WO-2025109628-A1 | A SYNERGISTIC TERNARY INSECTICIDAL COMPOSITION | RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) | 2025-05-30 | — | — | WO | claimed |
| CN-120004806-A | Functionalized alkaline ionic liquid compound, synthesis method thereof and application thereof in alkynylation reaction | 山东新和成精化科技有限公司 | 2025-05-16 | — | — | CN | claimed |
| CN-119776450-A | Bacillus bailii and application thereof in co-production of 6-methyl-2-heptanone and 2, 4-di-tert-butylphenol | 常熟理工学院 | 2025-04-08 | — | — | CN | claimed |
| CN-119191942-A | Alkynylation method of ketone compound | 万华化学集团股份有限公司 | 2024-12-27 | — | — | CN | claimed |
| US-20240298681-A1 | METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES | IMPOSSIBLE FOODS INC. | 2024-09-12 | — | — | US | claimed |
| WO-2024106740-A1 | COMPOSITION FOR CONTROLLING PHYTOPATHOGENIC FUNGI OR REDUCING MYCOTOXIN, COMPRISING CULTURE SOLUTION OF BACILLUS VELEZENSIS JCK-7158 OR EXTRACT OF STRAIN CULTURE SOLUTION, PREPARATION METHOD THEREFOR, AND METHOD FOR CONTROLLING PHYTOPATHOGENIC FUNGI OR REDUCING MYCOTOXIN | 전남대학교산학협력단 | 2024-05-23 | — | — | WO | claimed |
| CN-118026995-A | Dihydrotriazole aromatization precursor and application thereof in deacylating and arylating reaction of ketone | 国科大杭州高等研究院 | 2024-05-14 | — | — | CN | claimed |
| US-6232506-B1 | SUBJECTING ISOVALERALDEHYDE AND ACETONE TO CROSS ALDOL CONDENSATION CARRIED OUT WHILE CONTINUOUSLY ADDING TO ACETONE BOTH ISOVALERALDEHYDE AND AQUEOUS ALKALI CONTAINING ALKALINE SUBSTANCE TO GIVE 6-METHYL-3-HEPTEN-2-ONE | KURARAY CO., LYD. (JP) | 2001-05-15 | — | — | US | claimed |
| US-5955636-A | CROSS ALDOL CONDENSATION OF BRANCHED ALDEHYDE AND ACETONE; AQUEOUS ALKALI; HYDROGENATION CATALYST | KURARAY CO., LTD. (JP) | 1999-09-21 | — | — | US | claimed |
| EP-0765853-B1 | PROCESS FOR PREPARING 6-METHYLHEPTAN-2-ONE | KURARAY CO (JP) | 1999-07-07 | — | — | EP | claimed |
| US-5840992-A | Process for producing 6-methylheptan-2-one | KURARAY CO., LTD. (JP) | 1998-11-24 | — | — | US | claimed |
| EP-0816321-A1 | Process for producing 6-methyl-3-hepten-2-one and 6-methyl-2-heptanone analogues, and process for producing phyton or isophytol | KURARAY CO., LTD. (JP) | 1998-01-07 | — | — | EP | claimed |
| EP-0765853-A1 | PROCESS FOR PREPARING 6-METHYLHEPTAN-2-ONE | KURARAY CO., LTD. (JP) | 1997-04-02 | — | — | EP | claimed |
| US-4125735-A | Synthesis of esters of acetylenic alcohols | SCM CORPORATION (US) | 1978-11-14 | — | — | US | claimed |
| US-4115466-A | ACETYLENIC HYDROCARBONS FROM ACETYLENIC CARBINOLS, ISOMERIZATION | SCM CORPORATION (US) | 1978-09-19 | — | — | US | claimed |
| US-4039591-A | 1-ACETOXY-4-CHLORO-3-METHYLBUT-2-ENE | SCM CORPORATION (US) | 1977-08-02 | — | — | US | claimed |
| US-3979471-A | Process for synthesizing ethylenic compounds | AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) | 1976-09-07 | — | — | US | claimed |