⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8858984 | 0.97 | — | — | |
| SCHEMBL11805715 | 0.78 | — | — | |
| SCHEMBL21175201 | 0.74 | — | — | |
| SCHEMBL16353509 | 0.74 | OPRM1 (0.34) | — | |
| SCHEMBL12163500 | 0.72 | CA2 (0.33) | — | |
| SCHEMBL110670 | 0.71 | — | — | |
| SCHEMBL12549711 | 0.71 | — | — | |
| SCHEMBL12013704 | 0.71 | — | — | |
| SCHEMBL702981 | 0.70 | OPRM1 (0.36) | — | |
| SCHEMBL4368656 | 0.70 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140011785-A1 | LOCALLY ACTIVE \"SOFT\" ANTIANDROGENS | YALE UNIVERSITY (US) | 2014-01-09 | — | — | US | disclosed |
| US-8552061-B2 | Locally active “soft” antiandrogens | YALE UNIVERSITY (US) | 2013-10-08 | — | — | US | disclosed |
| EP-2532648-A1 | Locally active \"soft\" antiandrogens | Yale University (US) | 2012-12-12 | — | — | EP | disclosed |
| US-20100184735-A1 | LOCALLY ACTIVE \"SOFT\" ANTIANDROGENS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-07-22 | — | — | US | disclosed |
| EP-2150256-A1 | LOCALLY ACTIVE \"SOFT\" ANTIANDROGENS | YALE UNIVERSITY (US) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008137038-A1 | LOCALLY ACTIVE 'SOFT' ANTIANDROGENS | YALE UNIVERSITY (US) | 2008-11-13 | — | — | WO | disclosed |
| US-4396614-A | ALKYLATION, CARDIOVASCULAR DISORDERS | Uclaf, Roussel (FR) | 1983-08-02 | — | — | US | disclosed |