⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Sulfide SCHEMBL5961146 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL28340445 | 0.87 | — | — | |
| Water SCHEMBL28724797 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL27895632 | 0.87 | — | — | |
| Water SCHEMBL28836034 | 0.87 | — | — | |
| Hydrogen Sulfide SCHEMBL27750012 | 0.87 | — | — | |
| Phosphine SCHEMBL28729847 | 0.87 | — | — | |
| Hydrogen Sulfide SCHEMBL27689529 | 0.87 | — | — | |
| SCHEMBL18528961 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL63345 | 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-4945078-A | Mixed basic metal sulfide catalyst | INSTITUTE OF GAS TECHNOLOGY (US) | 1990-07-31 | — | — | US | disclosed |