⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL478635 | 0.90 | — | — | |
| SCHEMBL3186182 | 0.63 | — | — | |
| SCHEMBL411 | 0.63 | — | — | |
| SCHEMBL887973 | 0.63 | — | — | |
| SCHEMBL7692965 | 0.63 | — | — | |
| SCHEMBL5760792 | 0.63 | — | — | |
| SCHEMBL424252 | 0.63 | — | — | |
| SCHEMBL7691914 | 0.63 | — | — | |
| Bromide SCHEMBL1521338 | 0.60 | — | — | |
| SCHEMBL1486799 | 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-4384981-A | COORDINATION, INTERCALATION COMPOUND CONTAINING GROUP EIGHT METAL OR COMPOUND AND AN ORGANIC TETRAVALENT METALLIC COMPOUNDS | OCCIDENTAL RESEARCH CORPORATION (US) | 1983-05-24 | — | — | US | disclosed |