⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27771346 | 0.89 | — | — | |
| SCHEMBL433689 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL27273054 | 0.75 | — | — | |
| SCHEMBL27857228 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL27270078 | 0.75 | — | — | |
| Water SCHEMBL27878965 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL346821 | 0.58 | — | — | |
| Hydrogen Peroxide SCHEMBL1132457 | 0.58 | — | — | |
| Hydrogen Peroxide SCHEMBL348074 | 0.58 | — | — | |
| SCHEMBL153010 | 0.58 | — | — |
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-8034403-B2 | Method for forming copper distributing wires | ULVAC, INC. (JP) | 2011-10-11 | — | — | US | disclosed |