⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21670982 | 0.83 | TDP1 (0.33) | — | |
| SCHEMBL24245304 | 0.80 | TDP1 (0.42) | — | |
| SCHEMBL17902747 | 0.76 | TDP1 (0.46) | — | |
| SCHEMBL19439769 | 0.70 | TP53 (0.40) | — | |
| SCHEMBL10714083 | 0.66 | TDP1 (0.61) | — | |
| SCHEMBL13388879 | 0.66 | TDP1 (0.34) | — | |
| SCHEMBL13555513 | 0.65 | TDP1 (0.50) | — | |
| SCHEMBL13621716 | 0.65 | TDP1 (0.50) | — | |
| SCHEMBL15014918 | 0.62 | TDP1 (0.43) | — | |
| SCHEMBL17356545 | 0.62 | TDP1 (0.63) | — |
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-3080170-B1 | INSERTION POLYNORBORNENE-BASED THERMOSET RESINS | TRANSFERT PLUS SEC (CA) | 2020-02-05 | — | — | EP | disclosed |