Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.34 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 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 | |
|---|---|---|---|---|
| SCHEMBL25238260 | 1.00 | SMN1; SMN2 (0.41) | SMN1; SMN2CCNE1CDK2CCNB2CCNE2 | |
| SCHEMBL16320539 | 0.86 | ALDH1A1 (0.40) | SMN1; SMN2CCNE1CDK2CCNB2CCNE2 | |
| SCHEMBL17059345 | 0.84 | CCNB2 (0.51) | CCNE1CDK2CCNB2CCNE2CDK1 | |
| SCHEMBL19209814 | 0.82 | PAK4 (0.40) | SMN1; SMN2CDK2MAPK13CSNK1DCSNK1E | |
| SCHEMBL16320534 | 0.81 | PIK3CD (0.38) | CCNE1CDK2ALDH1A1COMTCSNK1D | |
| SCHEMBL30957592 | 0.79 | ALDH1A1 (0.40) | SMN1; SMN2CCNE1CDK2CCNB2CCNE2 | |
| SCHEMBL24900377 | 0.79 | ALDH1A1 (0.40) | SMN1; SMN2CCNE1CDK2CCNB2CCNE2 | |
| SCHEMBL30961370 | 0.76 | S1PR2 (0.42) | SMN1; SMN2CCNE1CDK2CCNB2CCNE2 | |
| SCHEMBL25694585 | 0.74 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL24054325 | 0.74 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1POLBMAPK1MAPT |
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-115697991-B | Piperazine cyclic ureas | 维泰瑞隆有限公司 | 2024-11-22 | — | — | CN | disclosed |
| CN-115697991-A | Piperazine cyclic ureas | 维泰瑞隆有限公司 | 2023-02-03 | — | — | CN | disclosed |