⚠ 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 SCHEMBL3430950 | 1.00 | — | — | |
| Hydrogen Sulfide SCHEMBL4019631 | 0.87 | — | — | |
| Hydrogen Sulfide SCHEMBL27998813 | 0.87 | — | — | |
| Hydrogen Sulfide SCHEMBL28860587 | 0.87 | — | — | |
| SCHEMBL7774126 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL8633100 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL11239718 | 0.82 | GSK3B (0.50) | — | |
| SCHEMBL1188574 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL8856827 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL418924 | 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-20050165120-A1 | Process for phase transfer of hydrophobic nanoparticles | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2005-07-28 | — | — | US | disclosed |