Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 7/20 | 0.40 |
| ▸ | CTSL | P07711 | 5/20 | 0.36 |
| ▸ | CTSB | P07858 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5555534 | 0.85 | KDM4E (0.62) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL5560667 | 0.85 | TSHR (0.41) | KDM4EPOLBTSHRCTSSCTSL | |
| SCHEMBL20267540 | 0.81 | TSHR (0.47) | KDM4EPOLBTSHRCTSSCTSL | |
| SCHEMBL22019302 | 0.80 | KDM4E (0.56) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL20584494 | 0.76 | KDM4E (0.54) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL4074497 | 0.75 | KDM4E (0.41) | KDM4EPOLBTSHRCTSSCTSL | |
| SCHEMBL3957626 | 0.75 | KDM4E (0.62) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL3301730 | 0.74 | TSHR (0.50) | KDM4EPOLBTSHRCTSSCTSL | |
| SCHEMBL3338802 | 0.74 | TSHR (0.50) | KDM4EPOLBTSHRCTSSCTSL | |
| SCHEMBL7260873 | 0.74 | KDM4E (0.61) | KDM4EPOLBTSHRCA1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1398315-B1 | Anti-inflammatory oxo-derivatives and hydroxy derivatives of pyrrolizines, and their pharmaceutical use | MERCKLE GMBH (DE) | 2007-08-08 | — | — | EP | disclosed |
| US-6878738-B1 | Anti-inflammatory oxo derivatives and hydroxy derivatives of pyrrolizines, and their pharmaceutical use | MERCKLE GMBH (DE) | 2005-04-12 | — | — | US | disclosed |
| EP-1398315-A1 | Anti-inflammatory oxo-derivatives and hydroxy derivatives of pyrrolizines, and their pharmaceutical use | MERCKLE GMBH (DE) | 2004-03-17 | — | — | EP | disclosed |
| WO-2001005792-A9 | ANTI-INFLAMMATORY OXO DERIVATIVES AND HYDROXY DERIVATIVES OF PYRROLIZINES, AND THEIR PHARMACEUTICAL USE | MERCKLE GMBH (DE) | 2002-08-29 | — | — | WO | disclosed |