⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8548357 | 0.83 | — | — | |
| SCHEMBL9347687 | 0.83 | MEN1 (0.38) | — | |
| SCHEMBL5583703 | 0.83 | MEN1 (0.38) | — | |
| SCHEMBL6339770 | 0.83 | MEN1 (0.38) | — | |
| SCHEMBL1774372 | 0.79 | — | — | |
| SCHEMBL3813934 | 0.75 | — | — | |
| SCHEMBL2194370 | 0.75 | — | — | |
| SCHEMBL5105617 | 0.71 | MEN1 (0.30) | — | |
| SCHEMBL4251521 | 0.71 | — | — | |
| SCHEMBL147168 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030212120-A1 | Compositions comprising a substituted benzimidazole useful for treating immunomediated inflammatory disorders | AXYS PHARMACEUTICALS, INC. (US) | 2003-11-13 | — | — | US | disclosed |
| US-6562854-B2 | Antiinflammatory agents; respiratory system disorders | AXYS PHARMACEUTICALS, INC. | 2003-05-13 | — | — | US | disclosed |
| US-20010053779-A1 | Novel compounds and compositions for treating diseases asociated with protease activity | Celera Corporation | 2001-12-20 | — | — | US | disclosed |
| US-6150379-A | BLOOD COAGULATION FACTOR XA INHIBITORS; TREATING DISEASES ASSOCIATED WITH SERINE PROTEASE ACTIVITY; THROMBOLYTIC AND ISCHEMIC AGENTS; E.G., 2-(6-(5-AMIDINO-1H-BENZIMIDAZOL-2-YL)-PYRID-3-YLCARBONYLAMINO)-3 -HYDROXYBUTYRIC ACID | AXYS PHARMACEUTICALS, INC. (US) | 2000-11-21 | — | — | US | disclosed |
| US-4690709-A | NONTOXIC AND NONPHYTOTOXIC PHOTOSYNTHESIS INHIBITORS; FUNGICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-09-01 | — | — | US | disclosed |
| US-4309212-A | POSTEMERGENCE, FUNGICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1982-01-05 | — | — | US | disclosed |