⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26631393 | 1.00 | — | — | |
| SCHEMBL26631307 | 0.78 | MAT2A (0.33) | — | |
| SCHEMBL30503542 | 0.78 | MAT2A (0.33) | — | |
| SCHEMBL26631414 | 0.77 | LRRK2 (0.41) | — | |
| SCHEMBL30503563 | 0.77 | LRRK2 (0.41) | — | |
| SCHEMBL26631326 | 0.77 | KMT2A (0.38) | — | |
| SCHEMBL30503576 | 0.77 | KMT2A (0.38) | — | |
| SCHEMBL9280556 | 0.70 | — | — | |
| SCHEMBL12127453 | 0.69 | OPRM1 (0.44) | — | |
| SCHEMBL30503547 | 0.68 | DYRK1A (0.49) | — |
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-116323557-A | Cyclobutylamide monoacylglycerol lipase modulators | 詹森药业有限公司 | 2023-06-23 | — | — | CN | disclosed |