⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5271209 | 0.70 | — | — | |
| SCHEMBL8313673 | 0.68 | — | — | |
| SCHEMBL5266987 | 0.63 | NOTUM (0.36) | — | |
| SCHEMBL8318100 | 0.59 | MAOB (0.33) | — | |
| SCHEMBL5273430 | 0.56 | PGR (0.37) | — | |
| SCHEMBL8759431 | 0.53 | ALPL (0.48) | — | |
| SCHEMBL10919614 | 0.51 | AHR (0.50) | — | |
| SCHEMBL6003668 | 0.50 | AHR (0.60) | — | |
| SCHEMBL522162 | 0.49 | TRPV4 (0.48) | — | |
| SCHEMBL29827885 | 0.49 | TRPV4 (0.48) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0632033-B1 | NOVEL BENZOPYRAN DERIVATIVE | CHUGAI PHARMACEUTICAL CO LTD (JP) | 1999-04-07 | — | — | EP | disclosed |
| US-5646308-A | POTASSIUM CHANNEL ACTIVATORS USED AS ANTIASTHMATICS, ANTIEPILEPTICS | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1997-07-08 | — | — | US | disclosed |
| EP-0632033-A1 | NOVEL BENZOPYRAN DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1995-01-04 | — | — | EP | disclosed |