⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4352031 | 1.00 | — | — | |
| SCHEMBL27902544 | 0.73 | — | — | |
| SCHEMBL823048 | 0.73 | — | — | |
| SCHEMBL22359156 | 0.69 | — | — | |
| SCHEMBL28194468 | 0.69 | — | — | |
| SCHEMBL19451453 | 0.69 | — | — | |
| SCHEMBL18409000 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL6841613 | 0.65 | — | — | |
| SCHEMBL10834378 | 0.63 | — | — | |
| SCHEMBL17923246 | 0.63 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090170886-A1 | ANDROGEN MODULATORS | PFIZER INC | 2009-07-02 | — | — | US | disclosed |
| EP-1915338-A2 | ANDROGEN MODULATORS | Warner-Lambert Company LLC (US) | 2008-04-30 | — | — | EP | disclosed |
| WO-2007017754-A2 | ANDROGEN MODULATORS | WARNER-LAMBERT COMPANY LLC (US) | 2007-02-15 | — | — | WO | disclosed |