⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4119628 | 0.79 | — | — | |
| SCHEMBL2589753 | 0.78 | GABRA1 (0.31) | — | |
| SCHEMBL19025853 | 0.78 | — | — | |
| SCHEMBL23044658 | 0.75 | RIPK1 (0.39) | — | |
| SCHEMBL11717665 | 0.71 | IDO1 (0.38) | — | |
| SCHEMBL263226 | 0.70 | — | — | |
| SCHEMBL2912097 | 0.67 | — | — | |
| SCHEMBL3557423 | 0.67 | — | — | |
| SCHEMBL3022868 | 0.64 | GABRA1 (0.54) | — | |
| SCHEMBL3022865 | 0.64 | GABRA1 (0.37) | — |
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-6242449-B1 | TREATING PROSTATIC HYPERTROPHY, URINATION DISORDERS ASSOCIATED WITH PROSTATIC HYPERTROPHY, MALE PATTERN ALOPECIA, OR ACNE | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-0997457-A1 | 3-BENZOYLINDOLE DERIVATIVES AND DRUGS CONTAINING THE SAME | ZERIA PHARMACEUTICAL CO., LTD. (JP) | 2000-05-03 | — | — | EP | disclosed |