⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL377128 | 0.88 | — | — | |
| Bromide SCHEMBL4412518 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL1953071 | 0.85 | — | — | |
| SCHEMBL2545678 | 0.85 | — | — | |
| Ammonia Solution, Strong SCHEMBL29055682 | 0.82 | FDPS (0.38) | — | |
| Hydrochloric Acid SCHEMBL28030030 | 0.82 | FDPS (0.38) | — | |
| Hydrochloric Acid SCHEMBL7711218 | 0.78 | — | — | |
| SCHEMBL726014 | 0.74 | — | — | |
| SCHEMBL7053194 | 0.74 | FDPS (0.41) | — | |
| SCHEMBL15901151 | 0.74 | FDPS (0.39) | — |
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-2521707-B1 | BISPHENOL DERIVATIVES AND THEIR USE AS ANDROGEN RECEPTOR ACTIVITY MODULATORS | BRITISH COLUMBIA CANCER AGENCY BRANCH (CA) | 2017-06-14 | — | — | EP | disclosed |