Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17119433 | 1.00 | S1PR1 (0.37) | S1PR1S1PR3SMN1; SMN2HTTKMT2A | |
| SCHEMBL22770846 | 0.85 | S1PR1 (0.36) | S1PR1S1PR3SMN1; SMN2HTTKMT2A | |
| SCHEMBL21718950 | 0.80 | S1PR1 (0.38) | S1PR1S1PR3SMN1; SMN2HTTKMT2A | |
| SCHEMBL2256015 | 0.80 | KMT2A (0.46) | HTTKMT2AALDH1A1PLA2G1BATG4B | |
| SCHEMBL15674471 | 0.78 | CYP11B1 (0.39) | HTTKMT2APLA2G1BATG4BIDO1 | |
| SCHEMBL13921765 | 0.77 | NOS3 (0.48) | HTTAGBL2KDM4EMAPTCYP2A6 | |
| SCHEMBL14941390 | 0.77 | KMT2A (0.34) | HTTKMT2APLA2G1BATG4BIDO1 | |
| SCHEMBL22447739 | 0.77 | KMT2A (0.43) | HTTKMT2AALDH1A1PLA2G1BATG4B | |
| SCHEMBL30598681 | 0.77 | KMT2A (0.43) | HTTKMT2AALDH1A1PLA2G1BATG4B | |
| SCHEMBL15674757 | 0.77 | PLAU (0.42) | SMN1; SMN2HTTKMT2AALDH1A1PLA2G1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111936503-B | Oxazine monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2023-09-12 | — | — | CN | disclosed |
| EP-4034538-A1 | NEW HETEROCYCLIC MONOACYLGLYCEROL LIPASE (MAGL) INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2022-08-03 | — | — | EP | disclosed |
| CN-114401968-A | Novel heterocyclic monoacylglycerol lipase (MAGL) inhibitors | 豪夫迈·罗氏有限公司 | 2022-04-26 | — | — | CN | disclosed |