Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 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 | |
|---|---|---|---|---|
| SCHEMBL7451055 | 0.82 | SMN1; SMN2 (0.37) | ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2 | |
| SCHEMBL6855320 | 0.81 | ADORA1 (0.43) | SMN1; SMN2L3MBTL1TP53 | |
| SCHEMBL20470648 | 0.77 | SMN1; SMN2 (0.41) | ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2 | |
| SCHEMBL3696311 | 0.75 | GLA (0.38) | ALDH1A1L3MBTL1KMT2ATP53 | |
| SCHEMBL15554665 | 0.73 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2 | |
| SCHEMBL18294954 | 0.71 | SMN1; SMN2 (0.55) | ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2 | |
| SCHEMBL25047048 | 0.70 | L3MBTL1 (0.44) | ALDH1A1SMN1; SMN2L3MBTL1TP53 | |
| SCHEMBL3698711 | 0.69 | — | — | |
| SCHEMBL15204695 | 0.68 | ALDH1A1 (0.34) | ALDH1A1L3MBTL1 | |
| SCHEMBL21526048 | 0.68 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2HCAR2CCNE1CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3083583-B1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS AND COMBINATIONS THEREOF | SAGIMET BIOSCIENCES INC (US) | 2020-11-18 | — | — | EP | disclosed |
| EP-2870150-B1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS | 3 V BIOSCIENCES INC (US) | 2019-06-19 | — | — | EP | disclosed |