Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | AGXT | P21549 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | LIPE | Q05469 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5766428 | 0.81 | ALDH1A1 (0.53) | ALDH1A1TSHRHCAR2BRD4LMNA | |
| SCHEMBL23553646 | 0.80 | LMNA (0.39) | ALDH1A1TSHRHCAR2LMNAIDO1 | |
| SCHEMBL23553983 | 0.78 | IDO1 (0.36) | ALDH1A1TSHRHCAR2NPC1RAB9A | |
| SCHEMBL5363575 | 0.77 | HCAR2 (0.59) | ALDH1A1TSHRHCAR2LMNASLC6A2 | |
| SCHEMBL5363573 | 0.77 | HCAR2 (0.59) | ALDH1A1TSHRHCAR2LMNASLC6A2 | |
| Hydrochloric Acid SCHEMBL5352171 | 0.76 | HCAR2 (0.58) | ALDH1A1TSHRHCAR2LMNAAGXT | |
| SCHEMBL11009967 | 0.75 | HCAR2 (0.49) | ALDH1A1HCAR2BRD4NPC1RAB9A | |
| SCHEMBL8291854 | 0.74 | ALDH1A1 (0.44) | ALDH1A1TSHRHCAR2NPC1RAB9A | |
| SCHEMBL5352165 | 0.74 | ALDH1A1 (0.53) | ALDH1A1TSHRHCAR2NPC1RAB9A | |
| SCHEMBL3463121 | 0.74 | HCAR2 (0.47) | ALDH1A1TSHRHCAR2NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119744259-A | Process for the preparation of 4-hydroxy-2-methylene-butyraldehyde, 4-hydroxy-2-methyl-but-2-enal and their esters | 巴斯夫欧洲公司 | 2025-04-01 | — | — | CN | disclosed |
| CN-119744258-A | Process for the preparation of 4-hydroxy-2-methylene-butyraldehyde, 4-hydroxy-2-methyl-but-2-enal and their esters | 巴斯夫欧洲公司 | 2025-04-01 | — | — | CN | disclosed |