Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22014551 | 0.76 | KMT2A (0.33) | ALDH1A1 | |
| SCHEMBL29889219 | 0.68 | ALDH1A1 (0.44) | MCL1ALDH1A1 | |
| SCHEMBL29889214 | 0.66 | CYP2C19 (0.43) | MCL1ALDH1A1 | |
| SCHEMBL23936833 | 0.64 | ALDH1A1 (0.40) | MCL1ALDH1A1 | |
| SCHEMBL29889521 | 0.64 | ALDH1A1 (0.40) | MCL1ALDH1A1 | |
| SCHEMBL29889358 | 0.62 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL22013440 | 0.61 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL23288603 | 0.61 | — | — | |
| SCHEMBL24512534 | 0.58 | HSD11B1 (0.46) | ALDH1A1 | |
| SCHEMBL22167636 | 0.56 | CYP2C19 (0.45) | MCL1ALDH1A1 |
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-3919490-A1 | FIVE-AND-SIX-MEMBERED HETEROCYCLIC COMPOUND AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITOR | Shanghai Ennovabio Pharmaceuticals Co., Ltd. (CN) | 2021-12-08 | — | — | EP | disclosed |
| WO-2020098720-A1 | FIVE-AND-SIX-MEMBERED HETEROCYCLIC COMPOUND AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITOR | 上海轶诺药业有限公司 | 2020-05-22 | — | — | WO | disclosed |