⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11392020 | 0.77 | — | — | |
| SCHEMBL9591940 | 0.74 | — | — | |
| SCHEMBL11672406 | 0.72 | GAA (0.41) | — | |
| SCHEMBL6257442 | 0.71 | — | — | |
| SCHEMBL12780211 | 0.70 | ALDH1A1 (0.36) | — | |
| SCHEMBL7942800 | 0.70 | — | — | |
| Dalapon SCHEMBL45164 | 0.70 | — | — | |
| SCHEMBL1678472 | 0.70 | TSHR (0.57) | — | |
| SCHEMBL301323 | 0.70 | — | — | |
| Dalapon SCHEMBL4895986 | 0.70 | TSHR (0.57) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1980917-B | Novel indole derivatives as selective androgen receptor modulators (SARMS) | JANSSEN PHARMACEUTICA NV | 2014-02-12 | — | — | CN | disclosed |
| EP-0100498-A1 | Process for the manufacture of dichlorolactic acid or the nitrile or the amide of dichlorolactic acid | BASF Aktiengesellschaft (DE) | 1984-02-15 | — | — | EP | disclosed |
| EP-0100498-A1 | Process for the manufacture of dichlorolactic acid or the nitrile or the amide of dichlorolactic acid | BASF Aktiengesellschaft (DE) | 1984-02-15 | — | — | EP | disclosed |