Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL2595074 | 1.00 | BACE1 (0.70) | BACE1BACE2 | |
| SCHEMBL362119 | 0.83 | BACE1 (1.00) | BACE1 | |
| SCHEMBL361903 | 0.81 | BACE1 (1.00) | BACE1 | |
| SCHEMBL7713115 | 0.81 | BACE1 (0.73) | BACE1 | |
| SCHEMBL2593701 | 0.80 | BACE1 (0.56) | BACE1BACE2 | |
| SCHEMBL2594303 | 0.80 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL7708898 | 0.80 | BACE1 (0.55) | BACE1BACE2 | |
| SCHEMBL15703699 | 0.74 | BACE1 (0.56) | BACE1 | |
| SCHEMBL15929894 | 0.73 | HTT (0.58) | BACE1 | |
| SCHEMBL10155382 | 0.73 | BACE1 (0.79) | BACE1 |
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-2011138293-A1 | 2,5,6,7-TETRAHYDRO-[1,4]OXAZEPIN-3-YLAMINE OR 2,3,6,7-TETRAHYDRO-[1,4]OXAZEPIN-5-YLAMINE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-10 | — | — | WO | claimed |
| WO-2011138293-A1 | 2,5,6,7-TETRAHYDRO-[1,4]OXAZEPIN-3-YLAMINE OR 2,3,6,7-TETRAHYDRO-[1,4]OXAZEPIN-5-YLAMINE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-10 | — | — | WO | disclosed |