⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13435197 | 0.84 | HSD11B1 (0.39) | — | |
| SCHEMBL13435196 | 0.82 | HSD11B1 (0.35) | — | |
| SCHEMBL3427038 | 0.77 | HSD11B1 (0.45) | — | |
| SCHEMBL5038669 | 0.75 | OPRM1 (0.30) | — | |
| SCHEMBL3426482 | 0.74 | HSD11B1 (0.34) | — | |
| SCHEMBL5662819 | 0.71 | HSD11B1 (0.33) | — | |
| SCHEMBL3427043 | 0.70 | — | — | |
| SCHEMBL3422925 | 0.62 | HSD11B1 (0.66) | — | |
| SCHEMBL14186140 | 0.61 | — | — | |
| SCHEMBL13435167 | 0.60 | HSD11B1 (0.38) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7687644-B2 | Adamantyl pyrrolidin-2-one derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors | JANSSEN PHARMACEUTICA NV (BE) | 2010-03-30 | — | — | US | disclosed |
| US-20070287743-A1 | Adamantyl Pyrrolidin-2-One Derivatives as 11-Beta Hydroxtsteroid Dehydrogenase Inhibitors | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-12-13 | — | — | US | disclosed |
| US-20070287743-A1 | Adamantyl Pyrrolidin-2-One Derivatives as 11-Beta Hydroxtsteroid Dehydrogenase Inhibitors | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-12-13 | — | — | US | disclosed |