Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 4/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | GPR183 | P32249 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776893 | 0.90 | SCD (0.39) | SCDPOLBHPGDRECQLHSD17B10 | |
| SCHEMBL4772658 | 0.81 | CACNA2D1 (0.39) | SCDHCRTR1HCRTR2EPHX2SCN5A | |
| SCHEMBL4775889 | 0.80 | SCN5A (0.42) | SCDHCRTR1HCRTR2EPHX2SCN5A | |
| SCHEMBL4753765 | 0.79 | HCRTR1 (0.44) | SCDHCRTR1HCRTR2SCN5ASCN9A | |
| SCHEMBL4774662 | 0.79 | CACNA1B (0.41) | SCDHCRTR1HCRTR2POLBHPGD | |
| Hydrochloric Acid SCHEMBL3466376 | 0.78 | HCRTR1 (0.43) | SCDHCRTR1HCRTR2SCN5ASCN9A | |
| SCHEMBL4794877 | 0.75 | HDAC8 (0.48) | SCDHCRTR1HCRTR2POLBHPGD | |
| SCHEMBL4780056 | 0.74 | SCD (0.38) | SCDHPGDMGLL | |
| SCHEMBL4778154 | 0.72 | ABL1 (0.34) | RECQLHSD17B10KMT2AKDM4E | |
| SCHEMBL4778523 | 0.72 | SCD (0.40) | SCDHSD17B10P2RX7MGLLKDM4E |
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-1996550-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | Novartis AG (CH) | 2008-12-03 | — | — | EP | disclosed |
| WO-2007038459-A2 | CARBOXYAMINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF HDAC DEPENDENT DISEASES | NOVARTIS AG (CH) | 2007-04-05 | — | — | WO | disclosed |