Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 6/20 | 0.34 |
| ▸ | RAB9A | P51151 | 6/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4216759 | 1.00 | CASP3 (0.35) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216763 | 1.00 | CASP3 (0.35) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216962 | 0.91 | RAB9A (0.41) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216954 | 0.91 | RAB9A (0.41) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216958 | 0.91 | RAB9A (0.41) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216987 | 0.90 | CASP3 (0.43) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216981 | 0.90 | CASP3 (0.43) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4216984 | 0.90 | CASP3 (0.43) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4222275 | 0.90 | KMT2A (0.41) | CASP3SENP8SENP7NPC1RAB9A | |
| SCHEMBL4222278 | 0.90 | KMT2A (0.41) | CASP3SENP8SENP7NPC1RAB9A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1963289-B1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | GRUENENTHAL GMBH (DE) | 2013-05-15 | — | — | EP | claimed |
| EP-1963289-A1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | Grünenthal GmbH (DE) | 2008-09-03 | — | — | EP | claimed |
| WO-2007079931-A1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | Grünenthal GmbH (DE) | 2007-07-19 | — | — | WO | claimed |
| EP-1963289-B1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | GRUENENTHAL GMBH (DE) | 2013-05-15 | — | — | EP | disclosed |
| CN-101384565-B | Substituted oxadiazole derivatives and their use as opioid receptor ligands | GRUENENTHAL GMBH | 2012-06-27 | — | — | CN | disclosed |
| CN-101384565-A | Substituted oxadiazole derivatives and their use as opioid receptor ligands | GRUENENTHAL GMBH (DE) | 2009-03-11 | — | — | CN | disclosed |
| EP-1963289-A1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | Grünenthal GmbH (DE) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007079931-A1 | SUBSTITUTED OXADIAZOLE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS | Grünenthal GmbH (DE) | 2007-07-19 | — | — | WO | disclosed |