⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7230094 | 1.00 | — | — | |
| SCHEMBL4300072 | 0.71 | ENPEP (0.32) | — | |
| SCHEMBL29369773 | 0.71 | — | — | |
| SCHEMBL7910161 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL270873 | 0.69 | — | — | |
| SCHEMBL5503133 | 0.69 | — | — | |
| SCHEMBL16927544 | 0.67 | — | — | |
| SCHEMBL7221591 | 0.66 | — | — | |
| SCHEMBL934967 | 0.66 | — | — | |
| SCHEMBL26092785 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6613782-B2 | For treating and/or preventing endothelin dependent conditions, e.g. cardio- and cerebro-vascular disorders such as hypertension, vasoconstriction, congestive heart failure, cerebral disorders, respiratory system disorders | NOVARTIS AG (CH) | 2003-09-02 | — | — | US | disclosed |
| US-6423727-B1 | Certain thiol inhibitors of endothelin-converting enzyme | NOVARTIS AG (CH) | 2002-07-23 | — | — | US | disclosed |
| US-20020082218-A1 | Certain thiol inhibitors of endothelin-converting enzyme | LOMBAERT STEPHANE DE (US) | 2002-06-27 | — | — | US | disclosed |
| EP-1073674-A1 | THIOL INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME | Novartis AG (CH) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999055726-A1 | CERTAIN THIOL INHIBITORS OF ENDOTHELIN-CONVERTING ENZYME | NOVARTIS AG (CH) | 1999-11-04 | — | — | WO | disclosed |
| US-5843753-A | Metalloprotease having increased activity | NOVO NORDISK A/S (DK) | 1998-12-01 | — | — | US | disclosed |
| US-5807729-A | ISOLATED NUCLEIC ACID | NOVO NORDISK A/S (DK) | 1998-09-15 | — | — | US | disclosed |
| US-5691162-A | OBTAINED FROM FUNGUS | NOVO NORDISK A/S (DK) | 1997-11-25 | — | — | US | disclosed |