Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9425866 | 0.82 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2LMNAMAPTGAA | |
| SCHEMBL9426354 | 0.82 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2PKMLMNAMAPT | |
| SCHEMBL9426037 | 0.81 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2LMNAMAPTGAA | |
| SCHEMBL9425868 | 0.78 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNAMAPTGAA | |
| SCHEMBL9425921 | 0.78 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNAGAAALOX12 | |
| SCHEMBL9426269 | 0.77 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2PKMLMNAMAPT | |
| SCHEMBL9426788 | 0.76 | NPC1 (0.60) | ALDH1A1SMN1; SMN2LMNAMAPTMEN1 | |
| Hydrochloric Acid SCHEMBL9426281 | 0.76 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2PKMLMNAMAPT | |
| SCHEMBL9426543 | 0.75 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2LMNAMAPTGAA | |
| SCHEMBL9426020 | 0.73 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2PKMLMNAMAPT |
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-2015055994-A1 | CYCLOPENTYLBENZAMIDE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PSYCHOTIC AND COGNITIVE DISORDERS | TAKEDA CAMBRIDGE LIMITED (GB) | 2015-04-23 | — | — | WO | disclosed |