Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5200876 | 0.88 | KMT2A (0.39) | KMT2AMEN1MAPK1NR1H2TDP1 | |
| SCHEMBL21946033 | 0.86 | KMT2A (0.38) | KMT2AMEN1MAPK1NR1H2TDP1 | |
| SCHEMBL7926354 | 0.86 | KMT2A (0.38) | KMT2AMEN1MAPK1NR1H2TDP1 | |
| SCHEMBL28776869 | 0.84 | MAOA (0.38) | KMT2AMEN1MAPK1CTSSCTSK | |
| SCHEMBL28391077 | 0.82 | CTSK (0.42) | KMT2AMEN1MAPK1CTSSCTSK | |
| SCHEMBL21946035 | 0.82 | CTSK (0.42) | KMT2AMEN1MAPK1CTSSCTSK | |
| SCHEMBL28776848 | 0.82 | CTSK (0.42) | KMT2AMEN1MAPK1CTSSCTSK | |
| SCHEMBL19931893 | 0.82 | KMT2A (0.36) | KMT2AMEN1MAPK1NR1H2TDP1 | |
| SCHEMBL31527127 | 0.82 | MEN1 (0.42) | KMT2AMEN1MAPK1BTKGAA | |
| SCHEMBL22362933 | 0.81 | MEN1 (0.41) | KMT2AMEN1MAPK1BTKGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111100086-B | 1,3, 4-oxadiazole-2-cyclobutyl compound and preparation method thereof | 南京圣和药业股份有限公司 | 2022-07-01 | — | — | CN | disclosed |
| CN-111100087-B | 1,3, 4-oxadiazole-2-cyclobutyl compound and preparation method and application thereof | 南京圣和药业股份有限公司 | 2022-07-01 | — | — | CN | disclosed |
| CN-111100087-A | 1,3, 4-oxadiazole-2-cyclobutyl compound and preparation method and application thereof | 南京圣和药业股份有限公司 | 2020-05-05 | — | — | CN | disclosed |
| CN-111100086-A | 1,3, 4-oxadiazole-2-cyclobutyl compound and preparation method thereof | 南京圣和药业股份有限公司 | 2020-05-05 | — | — | CN | disclosed |