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 | |
|---|---|---|---|---|
| SCHEMBL16624814 | 0.88 | SELE (0.35) | SELEVCAM1 | |
| SCHEMBL24227162 | 0.88 | SELE (0.35) | SELEVCAM1 | |
| SCHEMBL12228322 | 0.86 | TSHR (0.31) | — | |
| SCHEMBL19294654 | 0.86 | TSHR (0.31) | — | |
| SCHEMBL857517 | 0.79 | PDE4A (0.30) | — | |
| SCHEMBL19294662 | 0.79 | TSHR (0.33) | SELEVCAM1 | |
| SCHEMBL19294653 | 0.79 | SELE (0.31) | SELEVCAM1 | |
| SCHEMBL21919664 | 0.79 | — | — | |
| SCHEMBL20865971 | 0.76 | NOS2 (0.35) | — | |
| SCHEMBL20977931 | 0.74 | SELE (0.34) | SELEVCAM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010135568-A1 | BENZOXAZEPINES AS INHIBITORS OF MTOR AND THEIR USE TO TREAT CANCER | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |