⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL2162757 | 1.00 | — | — | |
| Fluoride SCHEMBL8152871 | 0.87 | — | — | |
| Fluoride SCHEMBL7885135 | 0.87 | — | — | |
| Fluoride SCHEMBL7111818 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL9117547 | 0.87 | — | — | |
| Charcoal, Activated SCHEMBL3432542 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL1003210 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL102042 | 0.82 | — | — | |
| Fluoride SCHEMBL155068 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL11114803 | 0.82 | — | — |
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-6359754-B1 | Increased mechanical spacing through localized continuous carbon overcoat | SEAGATE TECHNOLOGY LLC | 2002-03-19 | — | — | US | disclosed |