⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18555035 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL21752351 | 0.98 | HTT (0.33) | — | |
| SCHEMBL23544636 | 0.74 | FGFR1 (0.37) | — | |
| SCHEMBL193404 | 0.74 | — | — | |
| SCHEMBL29892829 | 0.74 | — | — | |
| SCHEMBL7111811 | 0.74 | — | — | |
| SCHEMBL1662310 | 0.74 | — | — | |
| SCHEMBL414351 | 0.74 | — | — | |
| SCHEMBL6644412 | 0.74 | — | — | |
| SCHEMBL9903875 | 0.74 | — | — |
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-4041714-A1 | BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS | Janssen Biotech, Inc. (US) | 2022-08-17 | — | — | EP | disclosed |