Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 18/20 | 0.98 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9307721 | 1.00 | SIGMAR1 (0.98) | SIGMAR1KCNJ1KCNH2 | |
| SCHEMBL9308511 | 0.89 | SIGMAR1 (0.98) | SIGMAR1 | |
| SCHEMBL9308508 | 0.89 | SIGMAR1 (0.98) | SIGMAR1 | |
| SCHEMBL9306851 | 0.85 | SIGMAR1 (0.97) | SIGMAR1 | |
| SCHEMBL9306844 | 0.85 | SIGMAR1 (0.97) | SIGMAR1 | |
| SCHEMBL9306847 | 0.85 | SIGMAR1 (0.97) | SIGMAR1 | |
| SCHEMBL9309148 | 0.78 | SIGMAR1 (0.98) | SIGMAR1 | |
| SCHEMBL9307840 | 0.75 | SIGMAR1 (0.97) | SIGMAR1 | |
| SCHEMBL9591663 | 0.75 | SIGMAR1 (0.59) | SIGMAR1KCNJ1KCNH2 | |
| SCHEMBL9308169 | 0.74 | SIGMAR1 (0.97) | SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5294618-A | Psychological disorders | MERCK SHARP & DOHME LIMITED (GB) | 1994-03-15 | — | — | US | disclosed |
| EP-0410535-A2 | Octahydrobenzisoquinoline derivatives as antipsychotic agents | MERCK SHARP & DOHME LTD. (GB) | 1991-01-30 | — | — | EP | disclosed |