Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4413137 | 0.91 | KDM4E (0.34) | LMNAKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL4423364 | 0.85 | ALDH1A1 (0.36) | NPSR1LMNAHTTKDM4EALDH1A1 | |
| SCHEMBL4416831 | 0.85 | ALDH1A1 (0.35) | NPSR1LMNAHTTKDM4EALDH1A1 | |
| SCHEMBL4411234 | 0.78 | — | — | |
| SCHEMBL309173 | 0.78 | ACACB (0.42) | NPSR1LMNAHTTKDM4EALDH1A1 | |
| SCHEMBL4414645 | 0.77 | — | — | |
| SCHEMBL4427903 | 0.76 | KHK (0.35) | HTT | |
| SCHEMBL4414075 | 0.76 | KHK (0.32) | — | |
| SCHEMBL3856615 | 0.74 | — | — | |
| SCHEMBL3864467 | 0.72 | PIK3CA (0.33) | — |
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-2111406-A1 | SUBSTITUTED SPIROCHROMANONE DERIVATIVES AS ACC INHIBITORS | Merck & Co., Inc. (US) | 2009-10-28 | — | — | EP | claimed |
| WO-2008088688-A1 | SUBSTITUTED SPIROCHROMANONE DERIVATIVES AS ACC INHIBITORS | MERCK & CO., INC. (US) | 2008-07-24 | — | — | WO | claimed |