Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 11/20 | 0.34 |
| ▸ | SLC16A1 | P53985 | 11/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.34 |
| ▸ | EP300 | Q09472 | 1/20 | 0.34 |
| ▸ | MCTS1 | Q9ULC4 | 5/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | EIF4EBP1 | Q13541 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6163574 | 0.93 | SLC16A3 (0.33) | SLC16A3SLC16A1CREBBPEP300MCTS1 | |
| SCHEMBL6606146 | 0.84 | CREBBP (0.33) | CREBBPEP300 | |
| SCHEMBL6609371 | 0.82 | CREBBP (0.38) | SLC16A3SLC16A1CREBBPEP300MCTS1 | |
| SCHEMBL6609350 | 0.80 | HSD11B1 (0.36) | CREBBPEP300RORC | |
| SCHEMBL6607850 | 0.80 | CREBBP (0.39) | CREBBPEP300 | |
| SCHEMBL6163707 | 0.80 | USP30 (0.36) | — | |
| SCHEMBL6608414 | 0.78 | NTRK1 (0.33) | CREBBPEP300RORC | |
| SCHEMBL6164800 | 0.78 | USP30 (0.37) | SLC16A3SLC16A1CREBBPEP300MCTS1 | |
| SCHEMBL6164138 | 0.77 | NPC1 (0.32) | CREBBPEP300 | |
| SCHEMBL6165370 | 0.77 | SLC6A9 (0.33) | CREBBPEP300 |
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-1379511-A1 | DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083652-A1 | DIHYDRO-BENZO [b] [1, 4] DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |