Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25618890 | 0.80 | HTT (0.36) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL23808019 | 0.78 | RECQL (0.35) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL29911994 | 0.78 | NPC1 (0.47) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL26388999 | 0.78 | — | — | |
| SCHEMBL26388988 | 0.77 | FFAR1 (0.34) | — | |
| SCHEMBL31710462 | 0.76 | KCNH2 (0.33) | HTTSMN1; SMN2KCNH2 | |
| SCHEMBL21224645 | 0.75 | IRAK4 (0.30) | — | |
| SCHEMBL18330127 | 0.74 | SMN1; SMN2 (0.39) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL18330041 | 0.73 | KLKB1 (0.39) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL1871681 | 0.73 | L3MBTL1 (0.40) | HTTSMN1; SMN2KDM4ENPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023192901-A9 | QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS | ESCIENT PHARMACEUTICALS, INC. (US) | 2023-12-14 | — | — | WO | disclosed |
| WO-2023192901-A1 | QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS | ESCIENT PHARMACEUTICALS, INC. (US) | 2023-10-05 | — | — | WO | disclosed |