Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 15/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 9/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19746307 | 0.89 | HDAC4 (0.47) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19746690 | 0.82 | HDAC6 (0.44) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19747032 | 0.82 | HDAC6 (0.48) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL31046614 | 0.82 | HDAC6 (0.44) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19746686 | 0.81 | HDAC4 (0.53) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19746864 | 0.81 | HDAC6 (0.46) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19747214 | 0.81 | HDAC6 (0.67) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19747212 | 0.81 | HDAC6 (0.53) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19746361 | 0.81 | HDAC6 (0.46) | HDAC6HDAC1HDAC8HDAC4 | |
| SCHEMBL19746418 | 0.81 | HDAC6 (0.57) | HDAC6HDAC1HDAC8HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017222952-A1 | 3- HETEROARYL SUBSTITUTED 5-TRIFLUOROMETHYL OXADIAZOLES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2017-12-28 | — | — | WO | claimed |