⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8541694 | 0.80 | LMNA (0.39) | — | |
| SCHEMBL384260 | 0.76 | — | — | |
| SCHEMBL127360 | 0.76 | — | — | |
| SCHEMBL11024353 | 0.69 | — | — | |
| SCHEMBL591736 | 0.67 | — | — | |
| SCHEMBL19259381 | 0.67 | LMNA (0.36) | — | |
| SCHEMBL27810145 | 0.67 | THRB (0.36) | — | |
| SCHEMBL13509597 | 0.67 | — | — | |
| SCHEMBL386380 | 0.65 | — | — | |
| SCHEMBL13458953 | 0.65 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5719155-A | CARDIOVASCULAR DISORDERS | JAPAN TOBACCO INC. (JP) | 1998-02-17 | — | — | US | disclosed |
| EP-0677519-A1 | CHROMAN DERIVATIVE AND MEDICINAL USE THEREOF | Japan Tobacco Inc. (JP) | 1995-10-18 | — | — | EP | disclosed |