⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29413911 | 0.84 | — | — | |
| SCHEMBL39578 | 0.84 | — | — | |
| SCHEMBL379958 | 0.84 | — | — | |
| SCHEMBL22996234 | 0.76 | — | — | |
| SCHEMBL29372287 | 0.74 | GABBR2 (0.35) | — | |
| SCHEMBL39043 | 0.74 | GABBR2 (0.35) | — | |
| SCHEMBL4252001 | 0.72 | RXRA (0.34) | — | |
| SCHEMBL7145505 | 0.72 | RXRA (0.34) | — | |
| SCHEMBL13038616 | 0.72 | — | — | |
| SCHEMBL17264263 | 0.71 | HTR1D (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8008423-B2 | Stabilized polyolefin compositions | POLNOX CORPORATION (US) | 2011-08-30 | — | — | US | claimed |