⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6404016 | 0.79 | — | — | |
| SCHEMBL6605020 | 0.77 | PDE10A (0.33) | — | |
| SCHEMBL6987551 | 0.73 | PDE10A (0.35) | — | |
| SCHEMBL6403213 | 0.73 | HDAC4 (0.39) | — | |
| SCHEMBL6078553 | 0.73 | PDE10A (0.35) | — | |
| Hydrochloric Acid SCHEMBL6400381 | 0.72 | HPGD (0.30) | — | |
| SCHEMBL6606605 | 0.71 | HPGD (0.38) | — | |
| SCHEMBL6985833 | 0.71 | PDE10A (0.34) | — | |
| SCHEMBL6979519 | 0.71 | PDE10A (0.34) | — | |
| SCHEMBL6399015 | 0.70 | KDM4E (0.34) | — |
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-20050288376-A1 | Bicyclyl or heterobicyclylmethanesulfonylanimo-substituted N-hydroxyformamides | SMITHKLINE BEECHAM PLC | 2005-12-29 | — | — | US | disclosed |
| EP-1289980-A1 | BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES | SMITHKLINE BEECHAM PLC (GB) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001090100-A1 | BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-11-29 | — | — | WO | disclosed |