⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22280167 | 0.77 | — | — | |
| SCHEMBL14404657 | 0.77 | — | — | |
| SCHEMBL11706106 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL11706114 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL4591815 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL7748539 | 0.70 | — | — | |
| SCHEMBL4559860 | 0.69 | — | — | |
| SCHEMBL295221 | 0.69 | — | — | |
| SCHEMBL264926 | 0.69 | — | — | |
| SCHEMBL2540688 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0015523-B1 | INDOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR MEDICAMENTS | Dr. Karl Thomae GmbH (DE) | 1982-10-13 | — | — | EP | disclosed |
| EP-0015523-A1 | Indole derivatives, their preparation and their use for medicaments | Dr. Karl Thomae GmbH (DE) | 1980-09-17 | — | — | EP | disclosed |