⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9514736 | 0.75 | — | — | |
| SCHEMBL18614761 | 0.71 | — | — | |
| SCHEMBL8909324 | 0.65 | — | — | |
| SCHEMBL24614 | 0.64 | — | — | |
| SCHEMBL514687 | 0.64 | — | — | |
| SCHEMBL10757995 | 0.62 | — | — | |
| SCHEMBL271616 | 0.61 | — | — | |
| SCHEMBL18369736 | 0.61 | — | — | |
| SCHEMBL18606044 | 0.60 | — | — | |
| SCHEMBL832099 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4353911-A | BLOOD CIRCULATION IN BRAIN | BUZAS ANDRE | 1982-10-12 | — | — | US | disclosed |