⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11727487 | 0.81 | UHRF1 (0.54) | — | |
| SCHEMBL31214385 | 0.79 | — | — | |
| SCHEMBL426759 | 0.79 | — | — | |
| SCHEMBL24727583 | 0.77 | — | — | |
| SCHEMBL11725501 | 0.77 | UHRF1 (0.45) | — | |
| SCHEMBL13660467 | 0.76 | UHRF1 (0.48) | — | |
| SCHEMBL16137360 | 0.74 | UHRF1 (0.46) | — | |
| SCHEMBL18331421 | 0.73 | — | — | |
| SCHEMBL13811390 | 0.72 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL16642356 | 0.72 | UHRF1 (0.45) | — |
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-3089966-B1 | NEW SUBSTITUTED BIPHENYL ANALOGUES AS DUAL INHIBITORS OF AROMATASE AND SULFATASE | ESTRYX PHARMA LTD (GB) | 2020-10-21 | — | — | EP | disclosed |