⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4448341 | 1.00 | — | — | |
| SCHEMBL9580139 | 0.78 | TSHR (0.38) | — | |
| SCHEMBL8847488 | 0.76 | TSHR (0.36) | — | |
| SCHEMBL4660365 | 0.76 | — | — | |
| SCHEMBL18092224 | 0.75 | — | — | |
| SCHEMBL8069445 | 0.75 | — | — | |
| SCHEMBL18092223 | 0.75 | — | — | |
| SCHEMBL313958 | 0.75 | TSHR (0.46) | — | |
| SCHEMBL2121230 | 0.74 | — | — | |
| SCHEMBL19446032 | 0.74 | — | — |
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-1346824-B1 | Compositions and methods for selectively cross-linking films and film articles resulting therefrom | CRYOVAC INC (US) | 2009-05-13 | — | — | EP | claimed |