⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26393 | 0.73 | — | — | |
| SCHEMBL10363024 | 0.71 | — | — | |
| SCHEMBL11486341 | 0.71 | — | — | |
| Fluoride SCHEMBL27557296 | 0.71 | — | — | |
| SCHEMBL12475179 | 0.69 | — | — | |
| SCHEMBL1020281 | 0.69 | — | — | |
| SCHEMBL28849861 | 0.69 | — | — | |
| SCHEMBL6784537 | 0.69 | — | — | |
| Alcohol SCHEMBL28808689 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL727360 | 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 |
|---|---|---|---|---|---|---|---|
| JP-11124349-A | — | — | None | — | — | JP | disclosed |