⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6255674 | 0.81 | — | — | |
| SCHEMBL6255677 | 0.81 | — | — | |
| SCHEMBL28889312 | 0.80 | — | — | |
| SCHEMBL1303234 | 0.76 | — | — | |
| SCHEMBL1412707 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL6898983 | 0.76 | — | — | |
| SCHEMBL3237151 | 0.75 | — | — | |
| SCHEMBL18023048 | 0.75 | — | — | |
| SCHEMBL25658403 | 0.71 | — | — | |
| Boric Acid SCHEMBL28617179 | 0.71 | — | — |
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-114106262-B | Polycarboxylic slump retaining agent and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-11-04 | — | — | CN | claimed |
| CN-114230728-A | Polycarboxylate superplasticizer and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-03-25 | — | — | CN | claimed |
| CN-114106262-A | Polycarboxylic slump retaining agent and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-03-01 | — | — | CN | claimed |
| CN-114106262-B | Polycarboxylic slump retaining agent and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-11-04 | — | — | CN | disclosed |
| CN-114230728-A | Polycarboxylate superplasticizer and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-03-25 | — | — | CN | disclosed |
| CN-114106262-A | Polycarboxylic slump retaining agent and preparation method thereof | 北京市建筑工程研究院有限责任公司 | 2022-03-01 | — | — | CN | disclosed |