⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL587475 | 0.77 | HDAC4 (0.38) | — | |
| SCHEMBL12791705 | 0.69 | L3MBTL1 (0.34) | — | |
| SCHEMBL587429 | 0.69 | HDAC4 (0.33) | — | |
| SCHEMBL31127615 | 0.65 | HRH3 (0.41) | — | |
| SCHEMBL16793351 | 0.61 | — | — | |
| SCHEMBL22361860 | 0.61 | CHRNB2 (0.41) | — | |
| SCHEMBL23388445 | 0.60 | — | — | |
| SCHEMBL167789 | 0.59 | — | — | |
| SCHEMBL20771411 | 0.57 | HDAC4 (0.39) | — | |
| SCHEMBL21853634 | 0.57 | HPGDS (0.42) | — |
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-1778673-A1 | NOVEL HYDANTOIN DERIVATIVES FOR THE TREATMENT OF OBSTRUCTIVE AIRWAY DISEASES | AstraZeneca AB (SE) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006004532-A1 | NOVEL HYDANTOIN DERIVATIVES FOR THE TREATMENT OF OBSTRUCTIVE AIRWAY DISEASES | ASTRAZENECA AB (SE) | 2006-01-12 | — | — | WO | disclosed |