⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL32686596 | 0.91 | MAP4K4 (0.42) | — | |
| SCHEMBL4013880 | 0.88 | QPCT (0.41) | — | |
| SCHEMBL12050015 | 0.88 | EPHX2 (0.46) | — | |
| SCHEMBL239491 | 0.86 | MEN1 (0.46) | — | |
| SCHEMBL13212415 | 0.82 | EPHX2 (0.43) | — | |
| SCHEMBL10205188 | 0.82 | EPHX2 (0.43) | — | |
| SCHEMBL15432007 | 0.81 | CHRNB2 (0.42) | — | |
| SCHEMBL17896807 | 0.81 | MAP4K4 (0.42) | — | |
| SCHEMBL20691034 | 0.79 | MEN1 (0.37) | — | |
| SCHEMBL20691035 | 0.78 | MAP4K4 (0.40) | — |
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-20110112151-A1 | COMPOUND CAPABLE OF INHIBITING 11-BETA HYDROXYSTERIOD DEHYDROGENASE | STERIX LIMITED (GB) | 2011-05-12 | — | — | US | disclosed |
| US-20110112151-A1 | COMPOUND CAPABLE OF INHIBITING 11-BETA HYDROXYSTERIOD DEHYDROGENASE | STERIX LIMITED (GB) | 2011-05-12 | — | — | US | disclosed |
| WO-2009106817-A2 | COMPOUND | STERIX LIMITED (GB) | 2009-09-03 | — | — | WO | disclosed |