⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21937319 | 0.86 | — | — | |
| SCHEMBL24901054 | 0.83 | IL1B (0.32) | — | |
| SCHEMBL21937318 | 0.83 | — | — | |
| SCHEMBL24900925 | 0.82 | IL1B (0.31) | — | |
| SCHEMBL18912002 | 0.79 | HSD17B10 (0.33) | — | |
| SCHEMBL21936263 | 0.73 | LMNA (0.30) | — | |
| SCHEMBL19675578 | 0.73 | ALDH1A1 (0.40) | — | |
| SCHEMBL19150952 | 0.73 | PIM1 (0.39) | — | |
| SCHEMBL21872491 | 0.72 | IL1B (0.34) | — | |
| SCHEMBL21936262 | 0.66 | — | — |
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-3381896-B1 | BIPHENYL COMPOUND OR SALT THEREOF | TAIHO PHARMACEUTICAL CO LTD (JP) | 2023-01-18 | — | — | EP | disclosed |