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 | |
|---|---|---|---|---|
| SCHEMBL19711877 | 0.85 | SIGMAR1 (0.59) | SIGMAR1KCNH2 | |
| SCHEMBL4553369 | 0.85 | NPC1 (0.52) | SIGMAR1KCNH2 | |
| SCHEMBL9768701 | 0.84 | SIGMAR1 (0.86) | SIGMAR1KCNH2 | |
| Hydrochloric Acid SCHEMBL2493107 | 0.83 | SIGMAR1 (0.57) | SIGMAR1KCNH2 | |
| Hydrochloric Acid SCHEMBL9344083 | 0.83 | L3MBTL1 (0.52) | SIGMAR1KCNH2 | |
| SCHEMBL14464611 | 0.82 | SIGMAR1 (0.63) | SIGMAR1KCNH2 | |
| SCHEMBL9602490 | 0.81 | SIGMAR1 (0.62) | SIGMAR1 | |
| SCHEMBL9191244 | 0.81 | SIGMAR1 (0.62) | SIGMAR1 | |
| SCHEMBL8027275 | 0.81 | SIGMAR1 (0.88) | SIGMAR1KCNH2 | |
| SCHEMBL10453660 | 0.80 | SIGMAR1 (0.91) | SIGMAR1KCNH2 |
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-3221314-B1 | SPIRO-ISOQUINOLINE-1,4'-PIPERIDINE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN | ESTEVE PHARMACEUTICALS SA (ES) | 2019-07-03 | — | — | EP | disclosed |