⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL573170 | 0.79 | DUT (0.35) | — | |
| SCHEMBL9756810 | 0.78 | — | — | |
| SCHEMBL12501691 | 0.74 | — | — | |
| SCHEMBL10433433 | 0.72 | ALDH1A1 (0.34) | — | |
| SCHEMBL19197243 | 0.70 | KDM4E (0.39) | — | |
| SCHEMBL28382295 | 0.69 | — | — | |
| SCHEMBL6213933 | 0.69 | — | — | |
| SCHEMBL10417657 | 0.69 | — | — | |
| SCHEMBL10416604 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL9794756 | 0.69 | — | — |
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-0353732-A2 | Fluoro-olefins, method for their preparation and their use | CIBA-GEIGY AG (CH) | 1990-02-07 | — | — | EP | disclosed |