⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25525820 | 0.81 | — | — | |
| SCHEMBL18769071 | 0.79 | — | — | |
| SCHEMBL25525738 | 0.77 | KDM4E (0.45) | — | |
| SCHEMBL23046369 | 0.77 | KDM4E (0.44) | — | |
| SCHEMBL19155573 | 0.77 | CES2 (0.41) | — | |
| SCHEMBL25876618 | 0.70 | KDM4E (0.44) | — | |
| SCHEMBL20697741 | 0.69 | KDM4E (0.43) | — | |
| SCHEMBL19085444 | 0.68 | AKT1 (0.38) | — | |
| SCHEMBL18792258 | 0.68 | AKT1 (0.38) | — | |
| SCHEMBL20068252 | 0.68 | CCR1 (0.34) | — |
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-3272784-B1 | POLYMER, RESIN COMPOSITION AND RESIN MOLDED BODY | JSR CORP (JP) | 2020-04-15 | — | — | EP | disclosed |