⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3376101 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL28682434 | 0.89 | — | — | |
| Sulfuric Acid SCHEMBL9725585 | 0.88 | MEN1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL6015225 | 0.87 | — | — | |
| SCHEMBL11150746 | 0.86 | — | — | |
| SCHEMBL5685624 | 0.85 | — | — | |
| SCHEMBL2194983 | 0.84 | — | — | |
| SCHEMBL9725576 | 0.83 | — | — | |
| SCHEMBL10613043 | 0.82 | SLC29A1 (0.31) | — | |
| SCHEMBL9638261 | 0.81 | — | — |
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-5173382-A | Mixture of water soluble polyvinyl alcohol, gelatin and gum arabic and a an aroamtic diazonium chromate | HITACHI, LTD. (JP) | 1992-12-22 | — | — | US | disclosed |