⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22018414 | 0.88 | KDM4E (0.32) | — | |
| SCHEMBL20325499 | 0.82 | — | — | |
| SCHEMBL20372771 | 0.82 | — | — | |
| SCHEMBL18591796 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL18591742 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL20322536 | 0.78 | SCN1A (0.34) | — | |
| SCHEMBL20443656 | 0.78 | — | — | |
| SCHEMBL25827254 | 0.77 | HRH3 (0.33) | — | |
| SCHEMBL22861730 | 0.74 | TSHR (0.40) | — | |
| SCHEMBL20671219 | 0.74 | KDM4E (0.33) | — |
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-20210220475-A1 | EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2021-07-22 | — | — | US | disclosed |