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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28354853 | 0.78 | HDAC4 (0.41) | KMT2A | |
| SCHEMBL4451679 | 0.78 | HDAC4 (0.41) | KMT2A | |
| SCHEMBL2783202 | 0.78 | TSHR (0.40) | ALDH1A1 | |
| SCHEMBL9458297 | 0.76 | APP (0.33) | — | |
| SCHEMBL9029796 | 0.74 | HSD11B1 (0.38) | ALDH1A1 | |
| SCHEMBL8429154 | 0.74 | BCL2L1 (0.40) | — | |
| SCHEMBL1252354 | 0.71 | KDM4E (0.34) | — | |
| SCHEMBL11438176 | 0.71 | — | — | |
| SCHEMBL27731834 | 0.68 | AKR1C1 (0.37) | ALDH1A1KMT2A | |
| SCHEMBL6517881 | 0.68 | KDM4E (0.33) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3997096-A1 | NEW HETEROCYCLIC COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2022-05-18 | — | — | EP | disclosed |