⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28606534 | 0.81 | F2 (0.30) | — | |
| SCHEMBL28355398 | 0.81 | F2 (0.30) | — | |
| SCHEMBL5489613 | 0.80 | — | — | |
| SCHEMBL31685202 | 0.77 | — | — | |
| SCHEMBL29189135 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL28734200 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL2719867 | 0.62 | — | — | |
| SCHEMBL2460679 | 0.61 | — | — | |
| SCHEMBL22361853 | 0.60 | LMNA (0.31) | — | |
| SCHEMBL22361857 | 0.60 | LMNA (0.31) | — |
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-112095343-A | Super-hydrophobic and super-oleophilic self-cleaning cotton fabric and preparation method and application thereof | 深圳大学 | 2020-12-18 | — | — | CN | claimed |
| CN-112095343-A | Super-hydrophobic and super-oleophilic self-cleaning cotton fabric and preparation method and application thereof | 深圳大学 | 2020-12-18 | — | — | CN | disclosed |