⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23486367 | 0.87 | KDM4E (0.51) | — | |
| SCHEMBL23453710 | 0.85 | — | — | |
| SCHEMBL23453735 | 0.85 | — | — | |
| SCHEMBL23453748 | 0.84 | MEN1 (0.57) | — | |
| SCHEMBL23453728 | 0.84 | MEN1 (0.57) | — | |
| SCHEMBL20489145 | 0.78 | MEN1 (0.50) | — | |
| SCHEMBL5568394 | 0.77 | KDM4E (0.56) | — | |
| SCHEMBL23486577 | 0.74 | GRIA1 (0.47) | — | |
| SCHEMBL17732130 | 0.74 | HCAR2 (0.47) | — | |
| SCHEMBL23453742 | 0.74 | KDM4E (0.49) | — |
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-20210171503-A1 | GLYCOLATE OXIDASE INHIBITORS AND USE THEREOF | ORFAN BIOTECH SL (ES) | 2021-06-10 | — | — | US | disclosed |