⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25226842 | 0.81 | — | — | |
| SCHEMBL16824955 | 0.81 | — | — | |
| SCHEMBL29483238 | 0.80 | CHRNB2 (0.33) | — | |
| SCHEMBL31719598 | 0.80 | — | — | |
| SCHEMBL1008154 | 0.80 | KDM4E (0.34) | — | |
| SCHEMBL31510752 | 0.80 | KDM4E (0.34) | — | |
| SCHEMBL31049036 | 0.76 | — | — | |
| SCHEMBL25911003 | 0.76 | DPP4 (0.31) | — | |
| SCHEMBL16824874 | 0.71 | CHRM2 (0.50) | — | |
| SCHEMBL25273884 | 0.71 | CHRNB2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3487856-B1 | SUBSTITUTED DIAZAHETERO-BICYCLIC COMPOUNDS AND THEIR USE | BAYER AG (DE) | 2025-01-22 | — | — | EP | disclosed |