Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 7/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | CRY1 | Q16526 | 6/20 | 0.38 |
| ▸ | CRY2 | Q49AN0 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8490612 | 1.00 | PER2 (0.40) | PER2S1PR1CRY1CRY2KDM4E | |
| SCHEMBL8489932 | 0.95 | PER2 (0.42) | PER2S1PR1CRY1CRY2KDM4E | |
| SCHEMBL8488600 | 0.86 | PER2 (0.38) | PER2CRY1CRY2KDM4EUSP2 | |
| SCHEMBL8487214 | 0.86 | PER2 (0.38) | PER2CRY1CRY2KDM4EUSP2 | |
| SCHEMBL9004290 | 0.86 | PER2 (0.38) | PER2CRY1CRY2BACE1 | |
| SCHEMBL8486390 | 0.85 | S1PR1 (0.36) | PER2S1PR1CRY1CRY2 | |
| SCHEMBL8489654 | 0.85 | S1PR1 (0.36) | PER2S1PR1CRY1CRY2 | |
| SCHEMBL8488753 | 0.83 | PER2 (0.51) | PER2CRY1CRY2KDM4EALDH1A1 | |
| SCHEMBL9004350 | 0.82 | MAPT (0.37) | PER2CRY1CRY2BACE1 | |
| SCHEMBL8491767 | 0.81 | PER2 (0.39) | PER2CRY1CRY2KDM4EUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |