Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL478779 | 0.83 | — | — | |
| Propionaldehyde SCHEMBL28848688 | 0.78 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL28166966 | 0.76 | HRH3 (0.39) | — | |
| SCHEMBL193780 | 0.74 | — | — | |
| SCHEMBL29957432 | 0.70 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL28166788 | 0.69 | L3MBTL1 (0.38) | ALDH1A1 | |
| Formic Acid SCHEMBL30730045 | 0.69 | HCAR2 (0.40) | — | |
| SCHEMBL17687127 | 0.67 | — | — | |
| SCHEMBL4559047 | 0.66 | NPC1 (0.36) | ALDH1A1 | |
| SCHEMBL2185888 | 0.66 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105189504-B | Fused tetracyclic bromodomain inhibitors | 艾伯维公司 | 2017-07-18 | — | — | CN | disclosed |