⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL90230 | 1.00 | — | — | |
| SCHEMBL8966592 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL11606989 | 0.93 | — | — | |
| Carbon Monoxide SCHEMBL5588916 | 0.78 | — | — | |
| Carbon Monoxide SCHEMBL5587938 | 0.78 | — | — | |
| Carbon Monoxide SCHEMBL3003056 | 0.78 | — | — | |
| SCHEMBL12473531 | 0.74 | — | — | |
| SCHEMBL9636879 | 0.68 | — | — | |
| SCHEMBL375371 | 0.50 | — | — | |
| Methyldiazonium SCHEMBL8788439 | 0.50 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8003689-B2 | Metabolites of selective androgen receptor modulators and methods of use thereof | GTX, INC. (US) | 2011-08-23 | — | — | US | disclosed |
| US-20100004326-A1 | METABOLITES OF SELECTIVE ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF | ONCTERNAL THERAPEUTICS, INC | 2010-01-07 | — | — | US | disclosed |