Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7965211 | 0.95 | ALDH1A1 (0.50) | ALDH1A1PPARGPPARAHPGDLTA4H | |
| SCHEMBL7968373 | 0.93 | ALDH1A1 (0.52) | ALDH1A1PPARGPPARALTA4HTSHR | |
| SCHEMBL7966776 | 0.89 | PPARG (0.43) | ALDH1A1PPARGPPARASMN1; SMN2KCNH2 | |
| SCHEMBL7629516 | 0.83 | ESR1 (0.34) | ALDH1A1PPARGPPARA | |
| SCHEMBL7952963 | 0.82 | MAOB (0.43) | ALDH1A1HPGDTSHRMAOB | |
| SCHEMBL7628651 | 0.82 | PPARG (0.36) | ALDH1A1PPARGPPARAHPGDCYP3A4 | |
| SCHEMBL6570510 | 0.79 | ALDH1A1 (0.36) | ALDH1A1PPARGPPARA | |
| SCHEMBL6570036 | 0.78 | ALDH1A1 (0.38) | ALDH1A1PPARGPPARATSHRTDP1 | |
| SCHEMBL6570054 | 0.77 | ALDH1A1 (0.36) | ALDH1A1PPARGPPARAHPGDCYP3A4 | |
| SCHEMBL7625127 | 0.76 | PPARG (0.34) | PPARGPPARALTA4HTSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6316459-B1 | O-benzyloxime ethers and crop protection agents containing these compounds | BASF AG (DE) | 2001-11-13 | — | — | US | disclosed |