⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11610789 | 0.62 | — | — | |
| SCHEMBL2346494 | 0.55 | — | — | |
| SCHEMBL52135 | 0.55 | — | — | |
| SCHEMBL30979366 | 0.54 | — | — | |
| SCHEMBL7433565 | 0.53 | — | — | |
| SCHEMBL220383 | 0.46 | — | — | |
| SCHEMBL11876929 | 0.46 | — | — | |
| SCHEMBL4407494 | 0.41 | — | — | |
| SCHEMBL6718539 | 0.33 | — | — | |
| SCHEMBL4584754 | 0.31 | — | — |
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-121399104-A | Process for preparing chiral pyrrolotriazolols | 豪夫迈·罗氏有限公司 | 2026-01-23 | — | — | CN | disclosed |