⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26198425 | 0.83 | — | — | |
| SCHEMBL2838140 | 0.80 | USP2 (0.33) | — | |
| SCHEMBL13472117 | 0.78 | DPP4 (0.32) | — | |
| SCHEMBL12788594 | 0.78 | MME (0.41) | — | |
| SCHEMBL22046874 | 0.76 | L3MBTL1 (0.30) | — | |
| SCHEMBL23205080 | 0.74 | CCR2 (0.30) | — | |
| SCHEMBL20462577 | 0.74 | MME (0.38) | — | |
| SCHEMBL12404656 | 0.73 | DPP4 (0.31) | — | |
| SCHEMBL22751828 | 0.70 | DPP4 (0.37) | — | |
| SCHEMBL13274125 | 0.70 | L3MBTL1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230278958-A1 | TRICYCLIC HETEROCYCLES | MERCK PATENT GMBH (DE) | 2023-09-07 | — | — | US | disclosed |
| US-20230174538-A1 | Tricyclic heterocycles | MERCK PATENT GMBH (DE) | 2023-06-08 | — | — | US | disclosed |