Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | LIG1 | P18858 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9853209 | 0.79 | MEN1 (0.43) | GAASMN1; SMN2KDM4EALDH1A1MAPK1 | |
| SCHEMBL6048186 | 0.72 | GAA (0.49) | HDAC1HDAC6HDAC8HDAC3HDAC4 | |
| SCHEMBL3081395 | 0.68 | HDAC1 (0.43) | HDAC1HDAC6HDAC8HDAC3HDAC4 | |
| SCHEMBL12879068 | 0.66 | PTPN1 (0.49) | HDAC6GAASMN1; SMN2KDM4EMPO | |
| SCHEMBL17255814 | 0.65 | GAA (0.53) | HDAC1HDAC6HDAC8HDAC3HDAC4 | |
| SCHEMBL21012218 | 0.65 | — | — | |
| SCHEMBL5176074 | 0.64 | ALDH1A1 (0.52) | HDAC1HDAC6HDAC8HDAC3HDAC4 | |
| SCHEMBL8637381 | 0.64 | MCL1 (0.41) | HDAC1HDAC6HDAC8HDAC3HDAC7 | |
| SCHEMBL10768728 | 0.63 | HDAC1 (0.38) | HDAC1HDAC6HDAC8HDAC3HDAC4 | |
| Ethane SCHEMBL28020377 | 0.63 | GAA (0.50) | HDAC1HDAC6HDAC8HDAC3HDAC4 |
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-0413293-A2 | 1-(Benzo[b]thienyl)-2-(thienyl) ethenes and related compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-02-20 | — | — | EP | disclosed |