⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2957217 | 0.82 | — | — | |
| SCHEMBL911535 | 0.78 | — | — | |
| SCHEMBL911212 | 0.78 | — | — | |
| SCHEMBL8768443 | 0.75 | — | — | |
| SCHEMBL5827 | 0.70 | — | — | |
| SCHEMBL13464554 | 0.70 | — | — | |
| SCHEMBL12478173 | 0.67 | — | — | |
| SCHEMBL9290864 | 0.67 | — | — | |
| SCHEMBL229715 | 0.67 | ALDH1A1 (0.35) | — | |
| SCHEMBL8171029 | 0.67 | ALDH1A1 (0.33) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0575524-B1 | PRODUCTS FOR TREATING GLAUCOMA | MASSACHUSETTS EYE & EAR INFIRM (US) | 2003-03-05 | — | — | EP | claimed |
| CN-117337190-A | Folate receptor targeted conjugates, compositions and delivery to the central nervous system | 普渡研究基金会 | 2024-01-02 | — | — | CN | disclosed |
| WO-2008097596-A2 | NRF2 SCREENING ASSAYS AND RELATED METHODS AND COMPOSITIONS | BIOGEN IDEC MA INC. (US) | 2008-08-14 | — | — | WO | disclosed |
| EP-1373346-A1 | ANIONIC POLYURETHANES WITH ELASTIC PROPERTY | L'OREAL (FR) | 2004-01-02 | — | — | EP | disclosed |
| EP-1192163-B1 | DITHIEPINO 6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS | ORTHO MCNEIL PHARM INC (US) | 2003-09-17 | — | — | EP | disclosed |
| WO-2002070577-A1 | ANIONIC POLYURETHANES WITH ELASTIC PROPERTY | L'OREAL (FR) | 2002-09-12 | — | — | WO | disclosed |
| US-20020103376-A1 | Dithiepino[6,5-b]pyridines, and related compositions and methods | BULLINGTON JAMES L (US) | 2002-08-01 | — | — | US | disclosed |
| EP-1192163-A1 | DITHIEPINO 6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS | Ortho-McNeil Pharmaceutical, Inc. (US) | 2002-04-03 | — | — | EP | 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 |
| WO-2000077009-A1 | DITHIEPINO[6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2000-12-21 | — | — | WO | disclosed |