Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL18202185 | 0.81 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1CYP2D6HTTKCNJ1 | |
| SCHEMBL23153769 | 0.79 | HTT (0.54) | ALDH1A1L3MBTL1CYP2D6HTTMAPT | |
| SCHEMBL29788525 | 0.78 | HTT (0.59) | ALDH1A1HTTKCNJ1MAPTKDM4E | |
| SCHEMBL310227 | 0.76 | KMT2A (0.51) | ALDH1A1L3MBTL1CYP2D6HTTMAPT | |
| SCHEMBL20247304 | 0.76 | CTSB (0.48) | ALDH1A1L3MBTL1CYP2D6KCNJ1MAPT | |
| SCHEMBL26351404 | 0.76 | HTT (0.54) | ALDH1A1L3MBTL1CYP2D6HTTMAPT | |
| SCHEMBL28959680 | 0.76 | MAPT (0.43) | ALDH1A1HTTMAPTNPC1SMN1; SMN2 | |
| SCHEMBL28959682 | 0.76 | TDP1 (0.46) | ALDH1A1L3MBTL1CYP2D6MAPTNPC1 | |
| SCHEMBL22471551 | 0.76 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1CYP2D6HTTKDM4E | |
| SCHEMBL4269241 | 0.75 | KCNJ1 (0.74) | ALDH1A1L3MBTL1CYP2D6HTTKCNJ1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025044897-A1 | CYCLIC 2-AMINOPYRIMIDINE COMPOUND AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 中国科学院上海有机化学研究所 | 2025-03-06 | — | — | WO | disclosed |