⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24093807 | 0.89 | — | — | |
| SCHEMBL24913114 | 0.83 | — | — | |
| SCHEMBL24037081 | 0.81 | AR (0.32) | — | |
| SCHEMBL14293621 | 0.81 | AR (0.32) | — | |
| SCHEMBL24912872 | 0.79 | TSHR (0.32) | — | |
| SCHEMBL19883305 | 0.77 | — | — | |
| SCHEMBL25122846 | 0.76 | — | — | |
| SCHEMBL22520248 | 0.74 | — | — | |
| SCHEMBL5948230 | 0.72 | — | — | |
| SCHEMBL12380161 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023284837-A1 | ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF | 四川海思科制药有限公司 | 2023-01-19 | — | — | WO | disclosed |