⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4731816 | 0.80 | — | — | |
| SCHEMBL18908546 | 0.71 | — | — | |
| SCHEMBL29103257 | 0.68 | — | — | |
| SCHEMBL1934225 | 0.62 | — | — | |
| SCHEMBL458118 | 0.62 | — | — | |
| SCHEMBL9328558 | 0.62 | — | — | |
| SCHEMBL19423555 | 0.61 | — | — | |
| SCHEMBL2499668 | 0.61 | — | — | |
| SCHEMBL27799963 | 0.61 | — | — | |
| SCHEMBL28875346 | 0.60 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111909437-A | Antibacterial HDPE plastic | 瑞普环保新材料(广州)有限公司 | 2020-11-10 | — | — | CN | claimed |
| CN-108084690-A | A kind of Multifunctional rubber based on nitrile rubber synthesis | 成都米利得科技有限公司 | 2018-05-29 | — | — | CN | claimed |
| CN-114159510-B | Tea oil antibacterial active substance, antibacterial tea oil, preparation method and application thereof | 湖南中医药大学 | 2023-06-20 | — | — | CN | disclosed |
| CN-114159510-A | Tea oil antibacterial active substance, antibacterial tea oil, and preparation method and application thereof | 湖南中医药大学 | 2022-03-11 | — | — | CN | disclosed |
| CN-111909437-A | Antibacterial HDPE plastic | 瑞普环保新材料(广州)有限公司 | 2020-11-10 | — | — | CN | disclosed |
| CN-108084690-A | A kind of Multifunctional rubber based on nitrile rubber synthesis | 成都米利得科技有限公司 | 2018-05-29 | — | — | CN | disclosed |
| CN-107868435-A | A kind of preparation method of the Multifunctional rubber based on nitrile rubber synthesis | 成都米利得科技有限公司 | 2018-04-03 | — | — | CN | disclosed |
| US-7429608-B2 | Benzo[d]imidazol analogs as vanilloid receptor ligands and their use in treatments | AMGEN INC. (US) | 2008-09-30 | — | — | US | disclosed |
| WO-2006078907-A1 | 2-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS | AMGEN INC. (US) | 2006-07-27 | — | — | WO | disclosed |
| US-20060160872-A1 | Vanilloid receptor ligands and their use in treatments | AMGEN INC. | 2006-07-20 | — | — | US | disclosed |