Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 3/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31020074 | 1.00 | KCNQ2 (0.53) | KCNQ2RIPK1NTRK1ALDH1A1L3MBTL1 | |
| SCHEMBL25290731 | 0.88 | KCNQ2 (0.46) | KCNQ2RIPK1NTRK1 | |
| SCHEMBL25290730 | 0.87 | KCNQ2 (0.45) | KCNQ2RIPK1NTRK1 | |
| SCHEMBL25245957 | 0.84 | KCNQ2 (0.51) | KCNQ2RIPK1NTRK1ALDH1A1 | |
| SCHEMBL30487373 | 0.84 | KCNQ2 (0.51) | KCNQ2RIPK1NTRK1ALDH1A1 | |
| SCHEMBL30487403 | 0.83 | KCNQ2 (0.50) | KCNQ2ALDH1A1L3MBTL1 | |
| SCHEMBL25246524 | 0.83 | KCNQ2 (0.50) | KCNQ2ALDH1A1L3MBTL1 | |
| SCHEMBL25774878 | 0.83 | KCNQ2 (0.36) | KCNQ2 | |
| SCHEMBL25776944 | 0.80 | KCNQ2 (0.66) | KCNQ2RIPK1 | |
| SCHEMBL30487412 | 0.79 | KCNQ2 (0.82) | KCNQ2 |
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-2024067819-A1 | PIPERIDINE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-04-04 | — | — | WO | disclosed |
| WO-2023125935-A1 | BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |
| WO-2023125935-A1 | BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |