⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL11169012 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28844299 | 0.96 | — | — | |
| Ammonia Solution, Strong SCHEMBL27998014 | 0.96 | — | — | |
| SCHEMBL4637 | 0.96 | — | — | |
| Fluoride SCHEMBL29094700 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL437146 | 0.92 | — | — | |
| Tert-Butanol SCHEMBL1357397 | 0.92 | ALDH1A1 (0.47) | — | |
| Tert-Butanol SCHEMBL10864533 | 0.92 | ALDH1A1 (0.47) | — | |
| SCHEMBL11002877 | 0.92 | — | — | |
| Methane SCHEMBL28155996 | 0.92 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109262373-A | The grinding method of zirconia ceramics | 东莞华晶粉末冶金有限公司 | 2019-01-25 | — | — | CN | claimed |
| CN-105505231-A | Efficient boron carbide grinding fluid and preparation method thereof | HUNAN HAOZHI TECH CO LTD | 2016-04-20 | — | — | CN | claimed |
| CN-109262373-A | The grinding method of zirconia ceramics | 东莞华晶粉末冶金有限公司 | 2019-01-25 | — | — | CN | disclosed |
| CN-108624182-A | High fire-retardance water-based acrylic resin lotion and high resistant burning coating material | 株洲飞鹿高新材料技术股份有限公司 | 2018-10-09 | — | — | CN | disclosed |
| CN-105505231-A | Efficient boron carbide grinding fluid and preparation method thereof | HUNAN HAOZHI TECH CO LTD | 2016-04-20 | — | — | CN | disclosed |