⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10638500 | 1.00 | — | — | |
| SCHEMBL6652022 | 0.84 | MEN1 (0.38) | — | |
| SCHEMBL31453550 | 0.78 | — | — | |
| SCHEMBL1300246 | 0.76 | — | — | |
| SCHEMBL690089 | 0.76 | — | — | |
| SCHEMBL690090 | 0.76 | — | — | |
| SCHEMBL12562520 | 0.74 | — | — | |
| SCHEMBL16467758 | 0.74 | CAD (0.48) | — | |
| SCHEMBL6950284 | 0.74 | — | — | |
| SCHEMBL5324369 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3740481-B1 | DIHYDROBENZOFURAN AND INDEN ANALOGS AS CARDIAC SARCOMERE INHIBITORS | CYTOKINETICS INC (US) | 2024-06-26 | — | — | EP | disclosed |