Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 4/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CKS1B | P61024 | 1/20 | 0.35 |
| ▸ | SKP1 | P63208 | 1/20 | 0.35 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2752401 | 0.91 | ADORA1 (0.47) | ADORA1NR1H2SMOMGLLHDAC6 | |
| SCHEMBL19609080 | 0.85 | NR1H2 (0.50) | NR1H2MGLLHDAC6ALDH1A1LMNA | |
| SCHEMBL14553991 | 0.82 | MGLL (0.43) | NR1H2MGLLHDAC6ALDH1A1LMNA | |
| SCHEMBL1817445 | 0.82 | ADORA1 (0.42) | ADORA1NR1H2MGLLHDAC6ALDH1A1 | |
| SCHEMBL14552561 | 0.79 | MGLL (0.44) | NR1H2MGLLHDAC6ALDH1A1LMNA | |
| SCHEMBL30014955 | 0.79 | SMO (0.44) | SMOHDAC6ALDH1A1LMNAGAA | |
| SCHEMBL5276608 | 0.78 | MGLL (0.44) | NR1H2MGLLHDAC6ALDH1A1HTT | |
| SCHEMBL5267788 | 0.76 | MGLL (0.44) | NR1H2MGLLHDAC6ALDH1A1LMNA | |
| SCHEMBL29697704 | 0.76 | NR1H2 (0.40) | ADORA1NR1H2MEN1ALDH1A1LMNA | |
| SCHEMBL15882223 | 0.76 | NR1H2 (0.40) | ADORA1NR1H2MEN1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3675847-B1 | SPIROCYCLE COMPOUNDS AND METHODS OF MAKING AND USING SAME | H LUNDBECK AS (DK) | 2023-07-12 | — | — | EP | disclosed |