⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7093400 | 0.88 | — | — | |
| SCHEMBL11780972 | 0.83 | — | — | |
| SCHEMBL6653639 | 0.81 | TRIM24 (0.43) | — | |
| SCHEMBL7092089 | 0.67 | TRIM24 (0.30) | — | |
| SCHEMBL6420729 | 0.65 | — | — | |
| SCHEMBL5457895 | 0.63 | — | — | |
| SCHEMBL2454966 | 0.61 | — | — | |
| SCHEMBL7093394 | 0.58 | — | — | |
| SCHEMBL4730800 | 0.56 | — | — | |
| SCHEMBL7094004 | 0.52 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1192163-B1 | DITHIEPINO 6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS | ORTHO MCNEIL PHARM INC (US) | 2003-09-17 | — | — | EP | disclosed |
| US-20020103376-A1 | Dithiepino[6,5-b]pyridines, and related compositions and methods | BULLINGTON JAMES L (US) | 2002-08-01 | — | — | US | disclosed |
| US-20020032332-A1 | Dithiepino[6,5-b]pyridines, and related compositions and methods | BULLINGTON JAMES L (US) | 2002-03-14 | — | — | US | disclosed |
| US-20020026051-A1 | Dithiepino [6,5-b]pyridines, and related compositions and methods | BULLINGTON JAMES L (US) | 2002-02-28 | — | — | US | disclosed |
| US-6291454-B1 | CALCIUM CHANNEL ANTAGONISTS WITH CARDIOVASCULAR, ANTIASTHINATIC AND ANTIBRONCHOCONSTRICTION ACTIVITY. | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2001-09-18 | — | — | US | disclosed |