Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9535642 | 0.84 | SMN1; SMN2 (0.43) | CNR1CNR2GPR55L3MBTL1ALDH1A1 | |
| SCHEMBL9536290 | 0.80 | GAA (0.41) | BACE1NPSR1ALDH1A1GAAPOLB | |
| SCHEMBL9538789 | 0.73 | ALDH1A1 (0.46) | L3MBTL1ALDH1A1GAAPOLBHPGD | |
| SCHEMBL9535895 | 0.70 | CNR1 (0.41) | CNR1CNR2GPR55ALDH1A1GAA | |
| SCHEMBL9536285 | 0.67 | SLC2A1 (0.38) | ALDH1A1GAAHPGDLMNAMAPT | |
| SCHEMBL28412705 | 0.67 | GAA (0.47) | ALDH1A1GAAHPGDCYP3A4 | |
| SCHEMBL17633590 | 0.67 | CSNK2A1 (0.43) | CNR1CNR2L3MBTL1NPSR1ALDH1A1 | |
| SCHEMBL22588510 | 0.66 | GAA (0.41) | ALDH1A1GAAHPGD | |
| SCHEMBL29449610 | 0.66 | GAA (0.41) | ALDH1A1GAAHPGD | |
| SCHEMBL8892263 | 0.65 | THRB (0.43) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | disclosed |
| EP-0151826-A1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-08-21 | — | — | EP | disclosed |