⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14699193 | 0.83 | — | — | |
| SCHEMBL9307693 | 0.82 | — | — | |
| SCHEMBL29253393 | 0.80 | — | — | |
| SCHEMBL26684718 | 0.80 | — | — | |
| SCHEMBL28072072 | 0.80 | — | — | |
| SCHEMBL471900 | 0.80 | — | — | |
| SCHEMBL556640 | 0.80 | — | — | |
| SCHEMBL1345314 | 0.80 | MAPT (0.32) | — | |
| SCHEMBL853633 | 0.80 | SCN2A (0.30) | — | |
| SCHEMBL1069722 | 0.80 | — | — |
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-116510692-A | Magnetic nano adsorbent, preparation method and application thereof | 广东工业大学 | 2023-08-01 | — | — | CN | claimed |
| CN-116510692-A | Magnetic nano adsorbent, preparation method and application thereof | 广东工业大学 | 2023-08-01 | — | — | CN | disclosed |