Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CCL5 | P13501 | 9/20 | 0.41 |
| ▸ | CCR5 | P51681 | 8/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL4689975 | 0.94 | KDM4E (0.50) | KMT2AKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL4692260 | 0.92 | PDK1 (0.45) | KDM4EALDH1A1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL4694276 | 0.92 | KDM4E (0.44) | KDM4EALDH1A1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL4691935 | 0.91 | KDM4E (0.42) | KMT2AKDM4EALDH1A1MAPTPOLB | |
| SCHEMBL4694250 | 0.89 | CCR5 (0.44) | ALDH1A1MAPTCCL5CCR5TP53 | |
| SCHEMBL4691837 | 0.84 | MAPK14 (0.40) | KDM4EALDH1A1MAPTCCL5CCR5 | |
| SCHEMBL4690865 | 0.84 | CCR5 (0.46) | ALDH1A1MAPTCCL5CCR5 | |
| SCHEMBL4693317 | 0.82 | EIF4A3 (0.49) | KMT2AALDH1A1MAPTCCL5CCR5 | |
| SCHEMBL4694467 | 0.81 | RIPK2 (0.46) | ALDH1A1POLBCCL5CCR5 | |
| SCHEMBL4692888 | 0.81 | MAPK14 (0.49) | — |
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-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | claimed |
| EP-1761542-A2 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-03-14 | — | — | EP | claimed |
| WO-2005121145-A2 | OCTAHYDRO-PYRROLO[3,4-C] DERIVATIVES AND THEIR USE AS ANTIVIRAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-12-22 | — | — | WO | claimed |
| EP-1761542-B1 | OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |