⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30080303 | 1.00 | — | — | |
| SCHEMBL20379039 | 0.92 | — | — | |
| SCHEMBL29574039 | 0.92 | — | — | |
| SCHEMBL30080336 | 0.85 | — | — | |
| SCHEMBL30080318 | 0.84 | — | — | |
| SCHEMBL23748078 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL30080589 | 0.83 | — | — | |
| SCHEMBL23748067 | 0.82 | — | — | |
| SCHEMBL24701891 | 0.80 | MEN1 (0.35) | — | |
| SCHEMBL25658526 | 0.80 | POLB (0.30) | — |
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-3864016-A1 | PROCESS FOR PREPARING SUBSTITUTED IMIDAZOLE DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2021-08-18 | — | — | EP | disclosed |