⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL156596 | 0.91 | — | — | |
| Tetrafluoroethylene SCHEMBL7671687 | 0.83 | — | — | |
| SCHEMBL28311878 | 0.74 | TSHR (0.35) | — | |
| Carbamic Acid SCHEMBL28172672 | 0.72 | ACHE (0.44) | — | |
| SCHEMBL9279849 | 0.72 | — | — | |
| SCHEMBL11768321 | 0.72 | TSHR (0.50) | — | |
| Fluoromethane SCHEMBL27662175 | 0.71 | — | — | |
| SCHEMBL7645121 | 0.70 | — | — | |
| SCHEMBL14775612 | 0.69 | HSD17B10 (0.33) | — | |
| SCHEMBL27904915 | 0.67 | — | — |
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-110041741-B | Efficient water-collecting self-cleaning super-amphiphobic coating and preparation method thereof | 东南大学 | 2021-03-02 | — | — | CN | disclosed |