Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 4/20 | 0.55 |
| ▸ | CRY1 | Q16526 | 3/20 | 0.55 |
| ▸ | CRY2 | Q49AN0 | 3/20 | 0.55 |
| ▸ | BACE1 | P56817 | 7/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8487228 | 0.90 | CRY1 (0.53) | PER2CRY1CRY2BACE1ALDH1A1 | |
| SCHEMBL8487896 | 0.90 | BACE1 (0.44) | PER2CRY1CRY2BACE1ALDH1A1 | |
| SCHEMBL9004296 | 0.89 | PER2 (0.43) | PER2CRY1CRY2BACE1TSHR | |
| SCHEMBL8491767 | 0.83 | PER2 (0.39) | PER2CRY1CRY2ALDH1A1L3MBTL1 | |
| SCHEMBL8488600 | 0.81 | PER2 (0.38) | PER2CRY1CRY2ALDH1A1L3MBTL1 | |
| SCHEMBL8491775 | 0.81 | PER2 (0.47) | PER2CRY1CRY2ALDH1A1L3MBTL1 | |
| SCHEMBL8487214 | 0.81 | PER2 (0.38) | PER2CRY1CRY2ALDH1A1L3MBTL1 | |
| SCHEMBL8488572 | 0.79 | BACE1 (0.48) | PER2CRY1CRY2BACE1ALDH1A1 | |
| SCHEMBL9004320 | 0.77 | PER2 (0.46) | PER2CRY1CRY2BACE1TSHR | |
| SCHEMBL8489489 | 0.77 | CRY1 (0.60) | PER2CRY1CRY2BACE1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5919431-A | 1,4,7,10-tetraazacyclododecane derivatives, their use, pharmaceutical agents containing these compounds and process for their production | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-07-06 | — | — | US | disclosed |
| EP-0730586-A1 | 1,4,7,10-TETRAAZACYCLODODECANE DERIVATIVES, THEIR USE, PHARMACEUTICALS CONTAINING THEM AND PROCESS FOR THEIR PRODUCTION | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014678-A1 | 1,4,7,10-TETRAAZACYCLODODECANE DERIVATIVES, THEIR USE, PHARMACEUTICALS CONTAINING THEM AND PROCESS FOR THEIR PRODUCTION | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-06-01 | — | — | WO | disclosed |