Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100B | P04271 | 1/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7822309 | 1.00 | S100B (0.59) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL3498339 | 0.87 | S100B (0.43) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL2746628 | 0.87 | CA2 (0.44) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL3499959 | 0.87 | S100B (0.43) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL2746630 | 0.87 | CA2 (0.44) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL12416630 | 0.82 | S100B (0.82) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL10733277 | 0.82 | S100B (0.82) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL10412841 | 0.82 | S100B (0.82) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL10733285 | 0.82 | S100B (0.82) | S100BPTGS2CA2PTGS1CA12 | |
| SCHEMBL2010515 | 0.82 | S100B (0.82) | S100BPTGS2CA2PTGS1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0681569-B1 | SPIROCYCLOALKYL-SUBSTITUTED AZETIDINONES USEFUL AS HYPOCHOLESTEROLEMIC AGENTS | SCHERING CORP (US) | 2001-03-21 | — | — | EP | disclosed |
| US-5698548-A | Spirocycloalkyl-substituted azetidinones useful as hypocholesterolemic agents | SCHERING CORPORATION (US) | 1997-12-16 | — | — | US | disclosed |