⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14856607 | 0.86 | KMT2A (0.41) | — | |
| SCHEMBL19285734 | 0.86 | KMT2A (0.41) | — | |
| SCHEMBL295997 | 0.86 | KMT2A (0.41) | — | |
| SCHEMBL18612439 | 0.75 | MEN1 (0.41) | — | |
| SCHEMBL2361923 | 0.75 | KDM4E (0.40) | — | |
| Nitric Acid SCHEMBL10641276 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL239699 | 0.75 | — | — | |
| SCHEMBL2737186 | 0.74 | — | — | |
| SCHEMBL21076290 | 0.74 | ALDH1A1 (0.63) | — | |
| SCHEMBL11140109 | 0.73 | TSHR (0.39) | — |
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 |