⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8088315 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL10382275 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL29735756 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL55999 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL912751 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL1607466 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL912261 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL135103 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL3215747 | 0.67 | — | — | |
| Methane SCHEMBL7865460 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001254142-A | HIGH CARBON BISMUTH-SULFUR COMPOSITE FREE-CUTTING STEEL, WIRE ROD THEREOF, AND STEEL WIRE THEREOF | KATO CENTERLESS HANBAI KK | 2001-09-18 | — | — | JP | disclosed |