Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.39 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10715612 | 0.94 | KMT2A (0.44) | LMNAL3MBTL1KCNH2CYP2D6ALDH1A1 | |
| SCHEMBL10718213 | 0.93 | LMNA (0.47) | LMNAL3MBTL1KCNH2CYP1A2CYP2D6 | |
| SCHEMBL10715749 | 0.90 | LMNA (0.44) | LMNAL3MBTL1KCNH2CYP1A2CYP2D6 | |
| SCHEMBL11068927 | 0.90 | KMT2A (0.47) | LMNAL3MBTL1KCNH2CYP2D6ALDH1A1 | |
| SCHEMBL11068933 | 0.90 | KMT2A (0.47) | LMNAL3MBTL1KCNH2CYP2D6ALDH1A1 | |
| SCHEMBL9511342 | 0.89 | ACACB (0.53) | LMNAL3MBTL1KCNH2GAAACACB | |
| SCHEMBL10715698 | 0.89 | ITGB3 (0.45) | LMNAL3MBTL1KCNH2CYP2D6GAA | |
| SCHEMBL10718185 | 0.88 | NQO1 (0.42) | LMNAKCNH2ACACBMEN1KMT2A | |
| SCHEMBL11058066 | 0.88 | LMNA (0.50) | LMNAL3MBTL1KCNH2CYP1A2CYP2D6 | |
| SCHEMBL11058060 | 0.88 | LMNA (0.50) | LMNAL3MBTL1KCNH2CYP1A2CYP2D6 |
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-0125563-B1 | BICYCLOHEXYL ETHANES | MERCK PATENT GmbH (DE) | 1987-05-27 | — | — | EP | disclosed |
| EP-0125563-A2 | Bicyclohexyl ethanes | MERCK PATENT GmbH (DE) | 1984-11-21 | — | — | EP | disclosed |