Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.67 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 6/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.60 |
| ▸ | MAPT | P10636 | 7/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29214971 | 1.00 | HDAC1 (0.67) | HDAC1FFAR1MEN1KMT2AMAPT | |
| SCHEMBL29215005 | 0.87 | FFAR1 (0.79) | HDAC1FFAR1MEN1KMT2AMAPT | |
| SCHEMBL29215003 | 0.87 | FFAR1 (0.79) | HDAC1FFAR1MEN1KMT2AMAPT | |
| SCHEMBL29214736 | 0.84 | ALDH1A1 (0.64) | HDAC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL29214732 | 0.84 | ALDH1A1 (0.64) | HDAC1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL18539174 | 0.80 | NPC1 (0.57) | FFAR1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL29245429 | 0.80 | HDAC1 (0.67) | HDAC1FFAR1MEN1KMT2AMAPT | |
| SCHEMBL29245434 | 0.80 | HDAC1 (0.67) | HDAC1FFAR1MEN1KMT2AMAPT | |
| SCHEMBL29518358 | 0.80 | FFAR1 (0.67) | FFAR1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL30869236 | 0.79 | MAPT (0.66) | MEN1KMT2AMAPTALDH1A1NPC1 |
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 |