⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25263661 | 0.90 | THRB (0.44) | — | |
| SCHEMBL20664064 | 0.90 | THRB (0.44) | — | |
| SCHEMBL20934549 | 0.90 | THRB (0.44) | — | |
| Hydrochloric Acid SCHEMBL25302443 | 0.88 | THRB (0.42) | — | |
| Hydrochloric Acid SCHEMBL25302442 | 0.88 | THRB (0.42) | — | |
| SCHEMBL17980420 | 0.86 | — | — | |
| SCHEMBL24569246 | 0.79 | — | — | |
| SCHEMBL10533313 | 0.78 | THRB (0.44) | — | |
| SCHEMBL24788125 | 0.78 | THRB (0.44) | — | |
| SCHEMBL459615 | 0.75 | THRB (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 |
|---|---|---|---|---|---|---|---|
| US-20230087118-A1 | IMIDAZO[1,2-a]PYRIDINYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE | BIOGEN MA INC. | 2023-03-23 | — | — | US | disclosed |