Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29698777 | 0.78 | LMNA (0.40) | HTTSMN1; SMN2KDM4ELMNANPSR1 | |
| SCHEMBL24096383 | 0.78 | LMNA (0.40) | HTTSMN1; SMN2KDM4ELMNANPSR1 | |
| SCHEMBL24671926 | 0.75 | LRRK2 (0.31) | — | |
| SCHEMBL115474 | 0.73 | HTT (0.33) | HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8532660 | 0.72 | KDM4E (0.39) | HTTSMN1; SMN2KDM4ELMNAMAPK1 | |
| SCHEMBL16461044 | 0.72 | LMNA (0.40) | SMN1; SMN2KDM4ELMNA | |
| SCHEMBL14165804 | 0.72 | HTT (0.35) | HTTSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL259072 | 0.72 | PDE10A (0.52) | HTTSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL29484711 | 0.72 | HTT (0.35) | HTTSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL116212 | 0.72 | HTT (0.37) | HTTSMN1; SMN2ALDH1A1 |
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-116669738-A | Pyrimidopyridone derivative as SOS1 inhibitor, and preparation method and application thereof | 苏州阿尔脉生物科技有限公司 | 2023-08-29 | — | — | CN | disclosed |
| WO-2022170802-A1 | PYRIMIDO-PYRIDONE DERIVATIVE AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州阿尔脉生物科技有限公司 | 2022-08-18 | — | — | WO | disclosed |
| WO-2022170802-A1 | PYRIMIDO-PYRIDONE DERIVATIVE AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州阿尔脉生物科技有限公司 | 2022-08-18 | — | — | WO | disclosed |