Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 8/20 | 0.74 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11739624 | 1.00 | GRM5 (0.74) | GRM5GAAKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL11740237 | 0.86 | GRM5 (0.76) | GRM5ALDH1A1L3MBTL1 | |
| SCHEMBL11734735 | 0.85 | GRM5 (1.00) | GRM5GAAALDH1A1MAPTKMT2A | |
| SCHEMBL11734749 | 0.85 | GRM5 (1.00) | GRM5GAAALDH1A1MAPTKMT2A | |
| SCHEMBL11748254 | 0.85 | GRM5 (0.74) | GRM5ALDH1A1MAPTKMT2ATP53 | |
| SCHEMBL11748260 | 0.85 | GRM5 (0.74) | GRM5ALDH1A1MAPTKMT2ATP53 | |
| SCHEMBL11738416 | 0.84 | GRM5 (0.62) | GRM5GAAKDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL11738480 | 0.84 | GRM5 (0.72) | GRM5KDM4EALDH1A1KMT2A | |
| SCHEMBL11738486 | 0.84 | GRM5 (0.72) | GRM5KDM4EALDH1A1KMT2A | |
| Water SCHEMBL11742984 | 0.84 | GRM5 (0.72) | GRM5KDM4EALDH1A1MAPTKMT2A |
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-4046909-A | Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants | MCNEIL LABORATORIES, INCORPORATED (US) | 1977-09-06 | — | — | US | disclosed |
| US-3998958-A | Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants | MCNEIL LABORATORIES, INCORPORATED (US) | 1976-12-21 | — | — | US | disclosed |