Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.57 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL17907554 | 0.91 | BACE1 (0.63) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175593 | 0.87 | BACE1 (0.62) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175619 | 0.86 | BACE1 (0.58) | BACE1BACE2CYP2D6 | |
| SCHEMBL1976751 | 0.86 | BACE1 (0.66) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175572 | 0.85 | BACE1 (0.63) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175570 | 0.83 | BACE1 (0.65) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175623 | 0.81 | BACE1 (0.74) | BACE1BACE2CYP2D6 | |
| SCHEMBL17907561 | 0.81 | BACE1 (0.69) | BACE1BACE2CYP2D6 | |
| SCHEMBL16175551 | 0.81 | BACE1 (0.55) | BACE1BACE2CYP2D6 | |
| SCHEMBL17907544 | 0.80 | BACE1 (0.61) | BACE1BACE2CYP2D6 |
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-2511268-B1 | OXAZINE DERIVATIVE | SHIONOGI & CO (JP) | 2016-07-13 | — | — | EP | claimed |
| EP-2509966-B1 | AMINO OXAZINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2014-10-22 | — | — | EP | claimed |