⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31668883 | 0.91 | — | — | |
| SCHEMBL3795938 | 0.89 | — | — | |
| SCHEMBL28994995 | 0.89 | — | — | |
| SCHEMBL29092730 | 0.89 | — | — | |
| SCHEMBL7608085 | 0.89 | — | — | |
| SCHEMBL28842390 | 0.80 | — | — | |
| SCHEMBL28684137 | 0.80 | — | — | |
| SCHEMBL28824625 | 0.80 | — | — | |
| SCHEMBL28160898 | 0.80 | — | — | |
| SCHEMBL31390199 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119571369-A | Preparation method and application of high-entropy alloy aerogel for electrocatalysis | 湖南师范大学 | 2025-03-07 | — | — | CN | disclosed |