Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | PKM | P14618 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9732722 | 0.81 | CTSA (0.41) | ALDH1A1RAB9AGAAMAPTNPC1 | |
| SCHEMBL9382970 | 0.81 | CTSA (0.41) | ALDH1A1RAB9AGAAMAPTNPC1 | |
| SCHEMBL9618662 | 0.78 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2L3MBTL1CTSA | |
| SCHEMBL9618663 | 0.78 | SMN1; SMN2 (0.43) | ALDH1A1SMN1; SMN2L3MBTL1CTSA | |
| SCHEMBL9732797 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9732803 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9383414 | 0.72 | NPSR1 (0.44) | ALDH1A1SMN1; SMN2L3MBTL1CTSA | |
| SCHEMBL9732591 | 0.69 | KDM4E (0.66) | ALDH1A1RAB9AGAAPKMMAPT | |
| SCHEMBL9735339 | 0.67 | MAPT (0.50) | ALDH1A1RAB9AGAAMAPTNPC1 | |
| SCHEMBL9384688 | 0.66 | CTSA (0.41) | ALDH1A1CTSA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992013846-A1 | PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES | CIBA-GEIGY AG (CH) | 1992-08-20 | — | — | WO | claimed |
| WO-1992013846-A1 | PYRIMIDINYL- AND TRIAZINYLSALICYL- AND -PICOLINYLALDEHYDE DERIVATIVES | CIBA-GEIGY AG (CH) | 1992-08-20 | — | — | WO | disclosed |