Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.44 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 9/20 | 0.41 |
| ▸ | PPARA | Q07869 | 9/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2252435 | 1.00 | HDAC8 (0.50) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL29658012 | 1.00 | HDAC8 (0.50) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL16657337 | 0.91 | HDAC8 (0.47) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL24446252 | 0.90 | CA12 (0.55) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL28491556 | 0.89 | HDAC8 (0.50) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL20622904 | 0.87 | HDAC8 (0.41) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL25625173 | 0.87 | MCL1 (0.44) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL25625218 | 0.87 | MCL1 (0.44) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL29995332 | 0.86 | TNF (0.52) | HDAC8HDAC6CA12CA1CA2 | |
| SCHEMBL16105349 | 0.86 | TNF (0.52) | HDAC8HDAC6CA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4048675-B1 | COMPOUNDS THAT CAN BE USED IN AN ORGANIC ELECTRONIC DEVICE | MERCK PATENT GMBH (DE) | 2026-04-08 | — | — | EP | disclosed |
| EP-4048675-A1 | COMPOUNDS THAT CAN BE USED IN AN ORGANIC ELECTRONIC DEVICE | Merck Patent GmbH (DE) | 2022-08-31 | — | — | EP | disclosed |
| CN-114630831-A | Compounds useful in organic electronic devices | 默克专利有限公司 | 2022-06-14 | — | — | CN | disclosed |