⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18522347 | 1.00 | — | — | |
| SCHEMBL23715015 | 1.00 | — | — | |
| SCHEMBL20709373 | 0.79 | — | — | |
| SCHEMBL24182103 | 0.79 | — | — | |
| SCHEMBL23104858 | 0.69 | — | — | |
| SCHEMBL21540404 | 0.69 | TDP1 (0.31) | — | |
| SCHEMBL23715016 | 0.67 | — | — | |
| SCHEMBL20763632 | 0.67 | — | — | |
| SCHEMBL527329 | 0.67 | — | — | |
| SCHEMBL8276690 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023083286-A1 | SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF | INSILICO MEDICINE IP LIMITED (CN) | 2023-05-19 | — | — | WO | disclosed |