Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MT-CO2 | P00403 | 2/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29048162 | 0.80 | PTGDR2 (0.43) | ALDH1A1KMT2AELANECYP2C9CYP2C19 | |
| SCHEMBL29048193 | 0.78 | PTGDR2 (0.42) | ALDH1A1GAAKMT2AMAPTMEN1 | |
| SCHEMBL29048165 | 0.72 | HTR1A (0.44) | ALDH1A1GAAKMT2AMAPTCYP1A2 | |
| SCHEMBL29048178 | 0.69 | ALDH1A1 (0.33) | ALDH1A1GAAKMT2AMAPTCYP1A2 | |
| SCHEMBL29048180 | 0.69 | ALDH1A1 (0.43) | ALDH1A1GAAKMT2AMAPTCYP2C9 | |
| SCHEMBL6055400 | 0.68 | ALDH1A1 (0.50) | ALDH1A1KMT2AELANECYP1A2CYP2C9 | |
| SCHEMBL10855612 | 0.68 | ALDH1A1 (0.51) | ALDH1A1KMT2AELANECYP1A2CYP2C9 | |
| SCHEMBL29048157 | 0.67 | PPARD (0.39) | GAAMAPTCYP2C9CYP2C19 | |
| SCHEMBL27468415 | 0.67 | HDAC1 (0.41) | ELANE | |
| SCHEMBL11497541 | 0.64 | NPC1 (0.35) | ALDH1A1GAAKMT2ACYP1A2CYP2C9 |
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-116283990-B | Application of substituted pyrrolidone compound as tumor necrosis factor inhibitor | 沈阳药科大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-116283990-A | Application of substituted pyrrolidone compound as tumor necrosis factor inhibitor | 沈阳药科大学 | 2023-06-23 | — | — | CN | disclosed |