Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9851723 | 0.98 | — | — | |
| SCHEMBL9851591 | 0.85 | TSHR (0.36) | — | |
| Bromide SCHEMBL9851562 | 0.84 | TSHR (0.35) | — | |
| SCHEMBL9851577 | 0.82 | KDM4E (0.40) | S1PR4S1PR1S1PR3S1PR5KDM4E | |
| Bromide SCHEMBL9851612 | 0.76 | CYP2D6 (0.35) | — | |
| SCHEMBL24316046 | 0.69 | S1PR4 (0.35) | S1PR4S1PR1S1PR3S1PR5KDM4E | |
| SCHEMBL6890281 | 0.69 | S1PR4 (0.35) | S1PR4S1PR1S1PR3S1PR5KDM4E | |
| SCHEMBL13564384 | 0.67 | S1PR4 (0.34) | S1PR4S1PR1S1PR3S1PR5KDM4E | |
| SCHEMBL9851573 | 0.67 | KDM4E (0.37) | KDM4E | |
| SCHEMBL27010330 | 0.67 | S1PR4 (0.32) | S1PR4S1PR1S1PR3S1PR5KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0417631-A2 | Condensed diazepinones, process for their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1991-03-20 | — | — | EP | disclosed |