Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25335529 | 1.00 | TDP1 (0.42) | TDP1MAP4K4KMT2ATGFBR1MEN1 | |
| SCHEMBL17205181 | 0.83 | ERN1 (0.43) | TDP1KMT2AMEN1ALDH1A1PPARG | |
| SCHEMBL28711698 | 0.79 | FFAR4 (0.44) | MAP4K4KMT2ATGFBR1PPARGGRM5 | |
| SCHEMBL29416783 | 0.79 | FFAR4 (0.44) | MAP4K4KMT2ATGFBR1PPARGGRM5 | |
| SCHEMBL875745 | 0.79 | SCN9A (0.46) | GRM5 | |
| SCHEMBL15096320 | 0.78 | TDP1 (0.47) | TDP1KMT2AMEN1ALDH1A1TRIM24 | |
| SCHEMBL25333228 | 0.78 | TDP1 (0.41) | TDP1KMT2AMEN1ALDH1A1TRIM24 | |
| SCHEMBL15809138 | 0.76 | TDP1 (0.62) | TDP1KMT2AMEN1ALDH1A1TRIM24 | |
| SCHEMBL8549679 | 0.76 | TDP1 (0.52) | TDP1KMT2AMEN1ALDH1A1TRIM24 | |
| SCHEMBL3303519 | 0.76 | ALDH1A1 (0.50) | TDP1KMT2AMEN1ALDH1A1 |
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-116234550-B | Aromatic formyl substituted tricyclic compound and preparation method and application thereof | 劲方医药科技(上海)股份有限公司 | 2024-12-27 | — | — | CN | disclosed |
| CN-116234550-A | Aromatic formyl substituted tricyclic compound and preparation method and application thereof | 劲方医药科技(上海)有限公司 | 2023-06-06 | — | — | CN | disclosed |
| WO-2022063101-A1 | AROYL SUBSTITUTED TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2022-03-31 | — | — | WO | disclosed |