⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6174741 | 0.78 | — | — | |
| SCHEMBL3128043 | 0.76 | — | — | |
| SCHEMBL18040205 | 0.76 | — | — | |
| SCHEMBL5268911 | 0.75 | — | — | |
| SCHEMBL11796685 | 0.73 | — | — | |
| SCHEMBL11697384 | 0.72 | — | — | |
| SCHEMBL9262454 | 0.71 | — | — | |
| SCHEMBL20833519 | 0.71 | — | — | |
| SCHEMBL15115490 | 0.71 | — | — | |
| SCHEMBL7377054 | 0.71 | ALDH1A1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117467190-A | Super-hydrophobic super-oleophylic sponge, preparation method thereof and application thereof in oil-water separation | 中国石油化工股份有限公司 | 2024-01-30 | — | — | CN | claimed |
| CN-117467190-A | Super-hydrophobic super-oleophylic sponge, preparation method thereof and application thereof in oil-water separation | 中国石油化工股份有限公司 | 2024-01-30 | — | — | CN | disclosed |