⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21936299 | 0.82 | — | — | |
| SCHEMBL19719762 | 0.73 | TDP1 (0.33) | — | |
| SCHEMBL20663172 | 0.73 | — | — | |
| SCHEMBL1816397 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL19606388 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL25123807 | 0.70 | TDP1 (0.31) | — | |
| SCHEMBL16627092 | 0.70 | — | — | |
| SCHEMBL20663280 | 0.69 | — | — | |
| SCHEMBL18755729 | 0.68 | — | — | |
| SCHEMBL21921031 | 0.68 | — | — |
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-3632443-B1 | ANTI-TUMOR EFFECT POTENTIATOR USING A BIPHENYL COMPOUND | TAIHO PHARMACEUTICAL CO LTD (JP) | 2023-06-07 | — | — | EP | disclosed |