⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL584332 | 0.97 | — | — | |
| SCHEMBL27723387 | 0.94 | — | — | |
| SCHEMBL27830614 | 0.94 | — | — | |
| SCHEMBL27792213 | 0.94 | — | — | |
| SCHEMBL27868964 | 0.94 | — | — | |
| SCHEMBL27830626 | 0.94 | — | — | |
| SCHEMBL11703285 | 0.94 | — | — | |
| Benzene SCHEMBL28216308 | 0.89 | THRB (0.38) | — | |
| SCHEMBL29006335 | 0.79 | CYP1A2 (0.33) | — | |
| SCHEMBL503771 | 0.79 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109486280-B | Two-component aqueous anti-graffiti coating containing water-soluble amino silicone oil for white board marker | 鳄鱼尼卡(上海)新材料有限公司 | 2022-02-01 | — | — | CN | claimed |
| CN-106467704-A | A kind of interior wall coating for children that can be used for scribbling and preparation method thereof | 鳄鱼制漆(上海)有限公司 | 2017-03-01 | — | — | CN | claimed |
| CN-104610514-A | Modified lignosulfonate water-reducing agent and preparation method thereof | FUJIAN QINGYUAN TECHNOLOGY CO LTD | 2015-05-13 | — | — | CN | claimed |
| CN-109486280-B | Two-component aqueous anti-graffiti coating containing water-soluble amino silicone oil for white board marker | 鳄鱼尼卡(上海)新材料有限公司 | 2022-02-01 | — | — | CN | disclosed |
| CN-113206348-A | Diaphragm slurry and application thereof, battery diaphragm and lithium ion battery | 昆山宝创新能源科技有限公司 | 2021-08-03 | — | — | CN | disclosed |
| CN-104610514-A | Modified lignosulfonate water-reducing agent and preparation method thereof | FUJIAN QINGYUAN TECHNOLOGY CO LTD | 2015-05-13 | — | — | CN | disclosed |