⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27590472 | 1.00 | — | — | |
| SCHEMBL27913618 | 1.00 | — | — | |
| SCHEMBL37301 | 1.00 | — | — | |
| Water SCHEMBL29797570 | 0.89 | — | — | |
| SCHEMBL28859574 | 0.89 | — | — | |
| SCHEMBL28572486 | 0.89 | — | — | |
| SCHEMBL28676889 | 0.89 | — | — | |
| Water SCHEMBL29797590 | 0.89 | — | — | |
| SCHEMBL10525977 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL22041618 | 0.89 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109499498-A | A kind of modification sol and its preparation method and application | 哈密市万泰瑞达新材料有限公司 | 2019-03-22 | — | — | CN | disclosed |
| CN-101412769-B | Load type non-metallocene catalyst and preparation thereof | SINOPEC YANGZI PETROCHEMICAL | 2014-05-07 | — | — | CN | disclosed |