⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20842928 | 0.85 | LMNA (0.35) | — | |
| SCHEMBL9967247 | 0.85 | TSHR (0.33) | — | |
| SCHEMBL10707675 | 0.84 | MAPT (0.34) | — | |
| SCHEMBL1638639 | 0.84 | MAPT (0.34) | — | |
| SCHEMBL10707670 | 0.84 | MAPT (0.34) | — | |
| SCHEMBL596042 | 0.84 | MAPT (0.34) | — | |
| SCHEMBL24202437 | 0.83 | LMNA (0.38) | — | |
| SCHEMBL2843100 | 0.83 | TSHR (0.42) | — | |
| SCHEMBL20842938 | 0.81 | MAPT (0.33) | — | |
| SCHEMBL12994128 | 0.81 | MAPT (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115836100-A | Polymerizable composition, cured product, and method for producing cured product | 株式会社艾迪科 | 2023-03-21 | — | — | CN | disclosed |