⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4448305 | 0.83 | — | — | |
| SCHEMBL35289 | 0.82 | — | — | |
| SCHEMBL5941380 | 0.82 | LMNA (0.32) | — | |
| Dimethylamine SCHEMBL430967 | 0.79 | — | — | |
| SCHEMBL20791552 | 0.79 | LMNA (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL5795187 | 0.78 | LMNA (0.31) | — | |
| Phosphine SCHEMBL27930582 | 0.78 | LMNA (0.31) | — | |
| Water SCHEMBL27451390 | 0.78 | LMNA (0.31) | — | |
| Hydrogen Sulfide SCHEMBL28072096 | 0.78 | LMNA (0.36) | — | |
| Fluoride SCHEMBL3875926 | 0.78 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2425990-B1 | TIRE | BRIDGESTONE CORP (JP) | 2014-12-24 | — | — | EP | claimed |