Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16962998 | 0.85 | KDM4E (0.40) | ALDH1A1 | |
| SCHEMBL30807502 | 0.85 | KDM4E (0.40) | ALDH1A1 | |
| SCHEMBL16961607 | 0.80 | MAPK1 (0.41) | ALDH1A1 | |
| SCHEMBL30807491 | 0.80 | MAPK1 (0.41) | ALDH1A1 | |
| SCHEMBL18983913 | 0.78 | KDM4E (0.40) | ALDH1A1 | |
| SCHEMBL11692364 | 0.76 | ALPL (0.33) | ALDH1A1 | |
| SCHEMBL102964 | 0.76 | KDM4E (0.35) | ALDH1A1 | |
| SCHEMBL8568181 | 0.73 | MAPT (0.52) | ALDH1A1 | |
| SCHEMBL2831954 | 0.73 | HCAR2 (0.32) | ALDH1A1ALOX15 | |
| SCHEMBL5685114 | 0.72 | SMN1; SMN2 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021032323-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | GALAPAGOS NV (BE) | 2021-02-25 | — | — | WO | disclosed |
| EP-3782997-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | Galapagos N.V. (BE) | 2021-02-24 | — | — | EP | disclosed |
| EP-3782997-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | Galapagos N.V. (BE) | 2021-02-24 | — | — | EP | disclosed |