⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7370064 | 1.00 | — | — | |
| SCHEMBL29264386 | 1.00 | — | — | |
| SCHEMBL10438965 | 0.83 | — | — | |
| SCHEMBL1033770 | 0.82 | — | — | |
| SCHEMBL1569242 | 0.80 | — | — | |
| SCHEMBL4725647 | 0.79 | — | — | |
| SCHEMBL1436523 | 0.78 | — | — | |
| SCHEMBL28289857 | 0.76 | — | — | |
| SCHEMBL27662318 | 0.76 | — | — | |
| SCHEMBL2021639 | 0.76 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116848107-A | Compounds and their use as PDE4 activators | 米罗尼德有限公司 | 2023-10-03 | — | — | CN | disclosed |