Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | MAX | P61244 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30868472 | 0.89 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MAPTHTTKMT2A | |
| SCHEMBL30868557 | 0.84 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPTTDP1HSP90AA1 | |
| SCHEMBL30868326 | 0.84 | L3MBTL1 (0.56) | ALDH1A1SMN1; SMN2MAPTHTTTP53 | |
| SCHEMBL17202457 | 0.84 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPTTDP1HSP90AA1 | |
| SCHEMBL679262 | 0.80 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MAPTCYP3A4ALOX15 | |
| SCHEMBL6342762 | 0.80 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MAPTCYP3A4ALOX15 | |
| SCHEMBL30868332 | 0.80 | SMN1; SMN2 (0.63) | ALDH1A1SMN1; SMN2MAPTTDP1KMT2A | |
| SCHEMBL26130709 | 0.78 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP3A4TDP1HTT | |
| SCHEMBL30868330 | 0.75 | HTT (0.51) | ALDH1A1SMN1; SMN2MAPTTDP1HTT | |
| SCHEMBL30868433 | 0.75 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2MAPTHTTKMT2A |
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-2024028169-A1 | NOVEL SPECIFICALLY SUBSTITUTED THIOPHENOLIC COMPOUNDS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2024-02-08 | — | — | WO | disclosed |