Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TNF | P01375 | 2/20 | 0.46 |
| ▸ | FPR2 | P25090 | 1/20 | 0.45 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.45 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.41 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11739687 | 1.00 | SIGMAR1 (0.50) | SIGMAR1MAPTRAB9ANPC1TNF | |
| SCHEMBL11742211 | 0.89 | SLC6A3 (0.50) | MAPTKDM4ELMNASMN1; SMN2GRM5 | |
| SCHEMBL11742215 | 0.89 | SLC6A3 (0.50) | MAPTKDM4ELMNASMN1; SMN2GRM5 | |
| SCHEMBL8326096 | 0.85 | L3MBTL1 (0.52) | MAPTRAB9ANPC1POLBKDM4E | |
| SCHEMBL8326098 | 0.85 | L3MBTL1 (0.52) | MAPTRAB9ANPC1POLBKDM4E | |
| SCHEMBL11738794 | 0.82 | SMN1; SMN2 (0.45) | SIGMAR1MAPTRAB9ANPC1POLB | |
| SCHEMBL11741169 | 0.82 | LMNA (0.53) | MAPTRAB9ANPC1LMNASMN1; SMN2 | |
| SCHEMBL11741176 | 0.82 | LMNA (0.53) | MAPTRAB9ANPC1LMNASMN1; SMN2 | |
| SCHEMBL11738799 | 0.82 | SMN1; SMN2 (0.45) | SIGMAR1MAPTRAB9ANPC1POLB | |
| SCHEMBL11741909 | 0.80 | MAPT (0.48) | MAPTRAB9ANPC1FPR2POLB |
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 |