Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL3 | Q96JM7 | 9/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 8/20 | 0.41 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.39 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.39 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.39 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28853366 | 0.81 | L3MBTL3 (0.42) | L3MBTL3L3MBTL1SMYD3MBTD1TP53BP1 | |
| SCHEMBL8730061 | 0.80 | L3MBTL3 (0.41) | L3MBTL3L3MBTL1SMYD3MBTD1TP53BP1 | |
| SCHEMBL22144419 | 0.80 | KDM4E (0.49) | L3MBTL3L3MBTL1MBTD1TP53BP1ALDH1A1 | |
| SCHEMBL15551035 | 0.79 | TRIM24 (0.61) | L3MBTL1TRIM24TRIM33ALDH1A1KDM4E | |
| SCHEMBL27632787 | 0.77 | LTA4H (0.50) | L3MBTL3L3MBTL1MBTD1HRH3 | |
| SCHEMBL8730118 | 0.77 | L3MBTL3 (0.44) | L3MBTL3L3MBTL1SMYD3ITGB3ITGA2B | |
| SCHEMBL14217337 | 0.77 | SPHK1 (0.51) | L3MBTL3L3MBTL1MBTD1TP53BP1KDM4E | |
| SCHEMBL6065386 | 0.77 | ALDH1A1 (0.62) | L3MBTL1TRIM24TRIM33ALDH1A1KDM4E | |
| SCHEMBL5545942 | 0.77 | SMYD3 (0.44) | L3MBTL3L3MBTL1SMYD3TRIM24TRIM33 | |
| SCHEMBL22119783 | 0.76 | ITGB3 (0.62) | L3MBTL3ITGB3ITGA2BMEN1KMT2A |
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-1909797-A2 | DIPIPERAZINYL KETONES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007016496-A2 | DIPIPERAZINYL KETONES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2007-02-08 | — | — | WO | disclosed |