⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1053963 | 0.86 | — | — | |
| Ethylene SCHEMBL28280242 | 0.80 | — | — | |
| SCHEMBL1872063 | 0.75 | — | — | |
| SCHEMBL10693453 | 0.75 | — | — | |
| SCHEMBL4728622 | 0.68 | — | — | |
| SCHEMBL27804786 | 0.67 | — | — | |
| Biphenyl SCHEMBL28987013 | 0.67 | ALDH1A1 (0.39) | — | |
| SCHEMBL27703421 | 0.67 | — | — | |
| SCHEMBL15547959 | 0.65 | TDP1 (0.31) | — | |
| SCHEMBL15547958 | 0.65 | TDP1 (0.31) | — |
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-114276667-B | Crystalline polyaryletherketone microsphere toughened polyaryletherketone material and preparation method thereof | 吉林大学 | 2023-04-18 | — | — | CN | disclosed |
| CN-114276667-A | Crystalline polyaryletherketone microsphere toughened polyaryletherketone material and preparation method thereof | 吉林大学 | 2022-04-05 | — | — | CN | disclosed |