⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16027145 | 0.79 | — | — | |
| SCHEMBL6293725 | 0.79 | — | — | |
| SCHEMBL7911515 | 0.76 | — | — | |
| SCHEMBL7908211 | 0.74 | — | — | |
| SCHEMBL5109759 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL6035054 | 0.73 | ALOX15 (0.34) | — | |
| SCHEMBL7691642 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL11061361 | 0.72 | ALDH1A1 (0.38) | — | |
| SCHEMBL174503 | 0.72 | — | — | |
| SCHEMBL3683540 | 0.72 | ALDH1A1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9192693-B2 | Method for treatment of emphysema | TERUMO KABUSHIKI KAISHA (JP) | 2015-11-24 | — | — | US | disclosed |
| US-20120053513-A1 | METHOD FOR TREATMENT OF EMPHYSEMA | TERUMO KABUSHIKI KAISHA (JP) | 2012-03-01 | — | — | US | disclosed |