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 | |
|---|---|---|---|---|
| SCHEMBL19553427 | 0.90 | CACNA2D1 (0.54) | CACNA2D1SLC6A2 | |
| SCHEMBL21747682 | 0.89 | CACNA2D1 (0.57) | CACNA2D1SLC6A2 | |
| SCHEMBL19553732 | 0.88 | CACNA2D1 (0.63) | CACNA2D1SLC6A2 | |
| SCHEMBL19553090 | 0.86 | CACNA2D1 (0.82) | CACNA2D1SLC6A2 | |
| SCHEMBL21747610 | 0.86 | CACNA2D1 (0.59) | CACNA2D1SLC6A2 | |
| SCHEMBL19554139 | 0.84 | CACNA2D1 (0.63) | CACNA2D1SLC6A2 | |
| SCHEMBL19554209 | 0.84 | CACNA2D1 (0.60) | CACNA2D1SLC6A2 | |
| SCHEMBL19553827 | 0.83 | CACNA2D1 (0.66) | CACNA2D1SLC6A2 | |
| SCHEMBL21747629 | 0.81 | CACNA2D1 (0.63) | CACNA2D1SLC6A2 | |
| SCHEMBL20970770 | 0.81 | CACNA2D1 (0.60) | CACNA2D1SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3452475-B1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | ESTEVE PHARMACEUTICALS SA (ES) | 2020-02-26 | — | — | EP | claimed |
| EP-3452475-A1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | ESTEVE PHARMACEUTICALS, S.A. (ES) | 2019-03-13 | — | — | EP | disclosed |
| WO-2017191304-A1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2017-11-09 | — | — | WO | disclosed |