⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27346367 | 0.83 | TGFBR1 (0.31) | — | |
| SCHEMBL27345085 | 0.78 | — | — | |
| SCHEMBL30719506 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL27346137 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL27346188 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL26025987 | 0.70 | OPRL1 (0.33) | — | |
| SCHEMBL27346398 | 0.69 | SIGMAR1 (0.32) | — | |
| SCHEMBL27346440 | 0.69 | PDE9A (0.30) | — | |
| SCHEMBL26065954 | 0.68 | — | — | |
| SCHEMBL26066064 | 0.68 | TLR9 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024015503-A1 | EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF | BIOGEN MA INC. (US) | 2024-01-18 | — | — | WO | disclosed |