Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15490071 | 1.00 | KMT2A (0.43) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL25379690 | 0.88 | EGFR (0.44) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL31053309 | 0.86 | HCAR2 (0.40) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL411643 | 0.86 | GAA (0.44) | KMT2ATDP1SMN1; SMN2MGAMGAA | |
| SCHEMBL29150029 | 0.86 | KMT2A (0.39) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL4283155 | 0.86 | KMT2A (0.42) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL5151822 | 0.86 | SMN1; SMN2 (0.41) | KMT2ATDP1PKMSMN1; SMN2NR4A1 | |
| SCHEMBL25379706 | 0.85 | MTNR1A (0.48) | KMT2ATDP1PKMSMN1; SMN2GAA | |
| SCHEMBL31116543 | 0.83 | DPP4 (0.48) | KMT2ATDP1PKMSMN1; SMN2HCAR2 | |
| SCHEMBL7253727 | 0.82 | TDP1 (0.41) | KMT2ATDP1PKMSMN1; SMN2NR4A1 |
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-117003758-A | Preparation method for synthesizing sitagliptin | 南通常佑药业科技有限公司 | 2023-11-07 | — | — | CN | claimed |
| CN-119798065-A | Preparation method of 2,4, 5-trifluoro phenylacetic acid | 山东东岳研究院有限公司 | 2025-04-11 | — | — | CN | disclosed |
| CN-116947638-A | Method for preparing sitagliptin intermediate by one-pot method | 淄博飞源化工有限公司 | 2023-10-27 | — | — | CN | disclosed |