Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 7/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | SCN1A | P35498 | 3/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 2/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | GALR1 | P47211 | 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 | |
|---|---|---|---|---|
| SCHEMBL29244152 | 0.81 | DYRK1A (0.43) | KCNH2SCN10APIM1PIM2GALR1 | |
| SCHEMBL29244205 | 0.71 | SCN9A (0.40) | SCN9A | |
| SCHEMBL2040458 | 0.69 | — | — | |
| SCHEMBL254957 | 0.68 | MAPT (0.56) | NISCHPIM1PIM2NOTUMKIF11 | |
| SCHEMBL10224674 | 0.67 | NISCH (0.38) | NISCHSCN5AKCNH2SCN1ASCN2A | |
| SCHEMBL16878883 | 0.66 | NISCH (0.49) | NISCHSCN5ASCN1ASCN2APIM2 | |
| SCHEMBL8111753 | 0.65 | KIF11 (0.56) | NISCHSCN5ASCN1ASCN2AKIF11 | |
| SCHEMBL14893848 | 0.65 | NISCH (0.44) | NISCHPIM1PIM2NOTUMPTGS2 | |
| SCHEMBL28616564 | 0.64 | KMT2A (0.53) | SCN5ASCN1ASCN2ANOTUM | |
| SCHEMBL306823 | 0.64 | KIF11 (0.50) | NISCHSCN5ASCN1ASCN2AKIF11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118290434-A | Spiropiperidine derivative containing alpha-methylene-gamma-butyrolactone, preparation method and application thereof | 南开大学 | 2024-07-05 | — | — | CN | claimed |
| CN-118290434-A | Spiropiperidine derivative containing alpha-methylene-gamma-butyrolactone, preparation method and application thereof | 南开大学 | 2024-07-05 | — | — | CN | disclosed |