⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL526234 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL27513198 | 0.77 | — | — | |
| SCHEMBL9311946 | 0.67 | — | — | |
| SCHEMBL2108995 | 0.60 | — | — | |
| SCHEMBL526797 | 0.59 | GAA (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL28937188 | 0.58 | GAA (0.31) | — | |
| SCHEMBL3756511 | 0.58 | — | — | |
| SCHEMBL15059388 | 0.57 | — | — | |
| SCHEMBL11218995 | 0.56 | CXCR4 (0.39) | — | |
| Hydrochloric Acid SCHEMBL4767443 | 0.56 | — | — |
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-6232381-B1 | MIXING WITH SODIUM ALKOXIDE | THE GOODYEAR TIRE & RUBBER COMPANY | 2001-05-15 | — | — | US | disclosed |