Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2190749 | 0.91 | CYP1A1 (0.36) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL27491 | 0.83 | TSHR (0.38) | TTRALBALDH1A1CYP2A6 | |
| SCHEMBL1978756 | 0.76 | CYP1A1 (0.30) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL22431368 | 0.73 | GRM5 (0.49) | — | |
| SCHEMBL16955503 | 0.71 | TSHR (0.31) | TTRALB | |
| SCHEMBL352200 | 0.71 | — | — | |
| SCHEMBL16950987 | 0.71 | FFAR4 (0.32) | TTRALBALDH1A1CYP2A6 | |
| SCHEMBL1979138 | 0.71 | TTR (0.40) | TTRALB | |
| SCHEMBL28671409 | 0.71 | CYP1A1 (0.43) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL13006866 | 0.70 | CYP2A6 (0.55) | CYP1A1CYP1A2CYP1B1ALDH1A1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011072064-A1 | S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2011-06-16 | — | — | WO | claimed |
| WO-2011072064-A1 | S PIRO [CHROMAN - 4, 4 ' - IMIDAZOL] ONES AS BETA - SECRETASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2011-06-16 | — | — | WO | disclosed |