⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31636062 | 0.89 | — | — | |
| SCHEMBL51433 | 0.81 | — | — | |
| SCHEMBL710882 | 0.80 | ALDH1A1 (0.30) | — | |
| SCHEMBL10621396 | 0.76 | — | — | |
| SCHEMBL3390049 | 0.76 | — | — | |
| SCHEMBL717313 | 0.74 | — | — | |
| SCHEMBL31087569 | 0.73 | — | — | |
| SCHEMBL6838930 | 0.71 | — | — | |
| SCHEMBL1921931 | 0.71 | — | — | |
| SCHEMBL1222657 | 0.71 | ALDH1A1 (0.30) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040254319-A1 | Flurofunctional statistical polymers with low glass transition temperature and method for obtaining the same | HYDRO-QUEBEC (CA) | 2004-12-16 | — | — | US | disclosed |
| WO-2003004463-A9 | FLUOROFUNCTIONAL STATISTICAL POLYMERS WITH LOW GLASS TRANSITION TEMPERATURE AND METHOD FOR OBTAINING SAME | HYDRO QUEBEC (CA) | 2003-12-24 | — | — | WO | disclosed |