⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL8622169 | 0.83 | — | — | |
| SCHEMBL30962340 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL10974993 | 0.82 | — | — | |
| SCHEMBL28108122 | 0.82 | — | — | |
| SCHEMBL456108 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL11222692 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL10334064 | 0.82 | — | — | |
| SCHEMBL9564471 | 0.82 | — | — | |
| SCHEMBL3086042 | 0.82 | — | — | |
| SCHEMBL456536 | 0.73 | — | — |
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-5720830-A | ADDING SOLID CARBIDE PARTICLES TO LIQUID FERROUS ALLOY, SOLIDIFYING | SHEFFIELD FORGEMASTERS LIMITED (GB) | 1998-02-24 | — | — | US | disclosed |