Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31465687 | 0.84 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1ATMCYP3A4KMT2A | |
| SCHEMBL31465675 | 0.83 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1ATMCYP3A4HPGD | |
| SCHEMBL31465683 | 0.83 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1ATMCYP3A4KMT2A | |
| SCHEMBL31465694 | 0.80 | CES2 (0.55) | ALDH1A1L3MBTL1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL6433021 | 0.78 | ALDH1A1 (0.57) | ALDH1A1CYP3A4HPGDKMT2AMEN1 | |
| SCHEMBL6430240 | 0.74 | ALDH1A1 (0.70) | ALDH1A1L3MBTL1CYP3A4KMT2AMEN1 | |
| SCHEMBL31465663 | 0.74 | ALDH1A1 (0.47) | ALDH1A1CYP3A4HPGDKMT2AMEN1 | |
| SCHEMBL18415563 | 0.73 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1ATMCYP3A4KMT2A | |
| SCHEMBL6431425 | 0.72 | ALDH1A1 (0.46) | ALDH1A1CYP3A4HPGDKMT2AMEN1 | |
| SCHEMBL31465700 | 0.71 | CYP3A4 (0.55) | ALDH1A1CYP3A4HPGDKMT2AMEN1 |
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-2025056724-A1 | IMINOAMIDE-TYPE COMPOUNDS AS LIGANDS FOR COPPER-CATALYZED COUPLING REACTIONS OF (HETERO)ARYL HALIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2025-03-20 | — | — | WO | disclosed |