⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL258990 | 1.00 | — | — | |
| SCHEMBL98868 | 1.00 | — | — | |
| SCHEMBL31065641 | 0.94 | — | — | |
| SCHEMBL16449832 | 0.94 | — | — | |
| Aziridine SCHEMBL30472771 | 0.82 | — | — | |
| SCHEMBL5702359 | 0.78 | KDM4E (0.36) | — | |
| SCHEMBL6668924 | 0.78 | — | — | |
| SCHEMBL11941337 | 0.78 | — | — | |
| SCHEMBL8051828 | 0.71 | — | — | |
| SCHEMBL16877643 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119116516-B | Polymer self-repairing material and preparation method thereof | 广东工业大学 | 2025-04-18 | — | — | CN | disclosed |
| CN-119116516-A | Polymer self-repairing material and preparation method thereof | 广东工业大学 | 2024-12-13 | — | — | CN | disclosed |
| US-20020042055-A1 | Alteration of hydrolase genes and screening of the resulting libraries for the ability to catalyze specific reactions | MAXYGEN, INC. | 2002-04-11 | — | — | US | disclosed |