⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16025168 | 0.81 | — | — | |
| SCHEMBL23936828 | 0.78 | SLC6A1 (0.59) | — | |
| SCHEMBL21806116 | 0.76 | — | — | |
| SCHEMBL18938813 | 0.75 | POLB (0.54) | — | |
| SCHEMBL10139268 | 0.75 | — | — | |
| SCHEMBL13476038 | 0.75 | HDAC8 (0.42) | — | |
| Hydrochloric Acid SCHEMBL21640413 | 0.74 | — | — | |
| SCHEMBL716529 | 0.74 | — | — | |
| SCHEMBL30798391 | 0.74 | — | — | |
| SCHEMBL1793321 | 0.72 | POLB (0.45) | — |
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-3475277-B1 | ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF | BIOIMICS AB (SE) | 2021-10-20 | — | — | EP | disclosed |