Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20399682 | 1.00 | JMJD6 (0.43) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL24880001 | 0.89 | ALDH1A1 (0.40) | JMJD6ALDH1A1MAPTGABRA1GABRG2 | |
| SCHEMBL29664441 | 0.87 | THRB (0.43) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL4018903 | 0.87 | THRB (0.43) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL15968597 | 0.85 | CA12 (0.46) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL6559030 | 0.85 | TSHR (0.47) | CYP2C9CYP2C19NPC1ALDH1A1NPSR1 | |
| SCHEMBL29859779 | 0.85 | TSHR (0.47) | CYP2C9CYP2C19NPC1ALDH1A1NPSR1 | |
| SCHEMBL7684716 | 0.84 | S1PR1 (0.49) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL17362538 | 0.84 | TARBP2 (0.42) | JMJD6CYP2C9CYP2C19NPC1ALDH1A1 | |
| SCHEMBL15431711 | 0.83 | ATM (0.47) | NPC1ALDH1A1NPSR1MAPTMAPK1 |
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-119451961-A | Carboxamide derivative with RSK inhibition effect, pharmaceutical composition containing carboxamide derivative and application of carboxamide derivative | 广州科恩泰生物医药科技有限公司 | 2025-02-14 | — | — | CN | disclosed |
| CN-117186098-A | Carboxamide derivative with RSK inhibition effect, pharmaceutical composition containing carboxamide derivative and application of carboxamide derivative | 上海科恩泰生物医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |