⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27315228 | 0.97 | — | — | |
| SCHEMBL19428195 | 0.97 | — | — | |
| SCHEMBL27949439 | 0.94 | — | — | |
| SCHEMBL27497795 | 0.94 | — | — | |
| SCHEMBL27554291 | 0.94 | — | — | |
| SCHEMBL7434852 | 0.94 | TSHR (0.32) | — | |
| Fluoride SCHEMBL27553092 | 0.94 | — | — | |
| Water SCHEMBL28170254 | 0.94 | — | — | |
| Bromide SCHEMBL27681667 | 0.94 | — | — | |
| Hydrogen Sulfide SCHEMBL28253847 | 0.94 | — | — |
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-1610128-A | Field effect device with gate dielectric and producing method thereof | IBM (US) | 2005-04-27 | — | — | CN | disclosed |