⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4186193 | 0.84 | PDE4B (0.34) | — | |
| SCHEMBL4192647 | 0.81 | HRH3 (0.39) | — | |
| SCHEMBL4181628 | 0.81 | — | — | |
| SCHEMBL4179199 | 0.80 | PDE5A (0.34) | — | |
| SCHEMBL4191491 | 0.79 | MAPK14 (0.32) | — | |
| SCHEMBL4189000 | 0.79 | HRH3 (0.34) | — | |
| SCHEMBL3908752 | 0.74 | ACLY (0.30) | — | |
| SCHEMBL4195123 | 0.73 | LRRK2 (0.33) | — | |
| SCHEMBL1091787 | 0.73 | — | — | |
| SCHEMBL1091788 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2021336-A2 | INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 | ELI LILLY AND COMPANY (US) | 2009-02-11 | — | — | EP | disclosed |
| WO-2007127688-A2 | INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 | ELI LILLY AND COMPANY (US) | 2007-11-08 | — | — | WO | disclosed |