⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2204826 | 0.76 | ALDH1A1 (0.43) | — | |
| SCHEMBL1370917 | 0.74 | — | — | |
| SCHEMBL6476930 | 0.74 | ALDH1A1 (0.37) | — | |
| SCHEMBL18512590 | 0.73 | — | — | |
| SCHEMBL1372367 | 0.73 | SOAT1 (0.42) | — | |
| SCHEMBL668401 | 0.72 | ALDH1A1 (0.52) | — | |
| SCHEMBL962321 | 0.71 | GLO1 (0.47) | — | |
| SCHEMBL9823358 | 0.71 | ALDH1A1 (0.62) | — | |
| SCHEMBL7262 | 0.71 | ALDH1A1 (0.62) | — | |
| SCHEMBL1331989 | 0.71 | ALDH1A1 (0.62) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9284345-B2 | 17alpha-substituted steroids as systemic antiandrogens and selective androgen receptor modulators | ENDORECHERCHE, INC. (CA) | 2016-03-15 | — | — | US | disclosed |
| EP-2147014-B1 | 17ALPHA-SUBSTITUTED STEROIDS AS SYSTEMIC ANTIANDROGENS AND SELECTIVE ANDROGEN RECEPTOR MODULATORS | ENDORECH INC (CA) | 2016-02-17 | — | — | EP | disclosed |
| EP-2147014-A1 | 17ALPHA-SUBSTITUTED STEROIDS AS SYSTEMIC ANTIANDROGENS AND SELECTIVE ANDROGEN RECEPTOR MODULATORS | Endorecherche, Inc. (CA) | 2010-01-27 | — | — | EP | disclosed |
| US-20090042844-A1 | 17ALPHA-SUBSTITUTED STEROIDS AS SYSTEMIC ANTIANDROGENS AND SELECTIVE ANDROGEN RECEPTOR MODULATORS | ENDORECHERCHE, INC. | 2009-02-12 | — | — | US | disclosed |
| WO-2008124922-A1 | 17ALPHA-SUBSTITUTED STEROIDS AS SYSTEMIC ANTIANDROGENS AND SELECTIVE ANDROGEN RECEPTOR MODULATORS | ENDORECHERCHE, INC. (CA) | 2008-10-23 | — | — | WO | disclosed |