Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30869230 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214749 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL30869257 | 0.89 | MMP1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214801 | 0.89 | MMP1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214795 | 0.89 | MMP1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL30869234 | 0.89 | HDAC1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214939 | 0.89 | HDAC1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214935 | 0.89 | HDAC1 (0.54) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214736 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL29214732 | 0.84 | ALDH1A1 (0.64) | ALDH1A1MITFPOLBRAB9ASMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117777049-B | Thiazolidinedione HDAC inhibitor, preparation method and application | 南京市鸿舜医药科技有限公司 | 2024-05-31 | — | — | CN | claimed |
| CN-117777049-A | Thiazolidinedione HDAC inhibitor, preparation method and application | 南京市鸿舜医药科技有限公司 | 2024-03-29 | — | — | CN | claimed |
| CN-117777049-B | Thiazolidinedione HDAC inhibitor, preparation method and application | 南京市鸿舜医药科技有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-117777049-A | Thiazolidinedione HDAC inhibitor, preparation method and application | 南京市鸿舜医药科技有限公司 | 2024-03-29 | — | — | CN | disclosed |