Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.51 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.45 |
| ▸ | KCNQ4 | P56696 | 4/20 | 0.45 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.45 |
| ▸ | MAOA | P21397 | 4/20 | 0.40 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | PYCR1 | P32322 | 2/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 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 | |
|---|---|---|---|---|
| SCHEMBL31019991 | 0.80 | CYP1A2 (0.53) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25293405 | 0.80 | CYP1A2 (0.53) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25287981 | 0.79 | CYP1A2 (0.66) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25246747 | 0.78 | CYP1A2 (0.59) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL30487333 | 0.76 | CYP1A2 (0.80) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25774746 | 0.76 | CYP1A2 (0.80) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25246740 | 0.76 | CYP1A2 (0.51) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL31020099 | 0.76 | CYP1A2 (0.51) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL25774737 | 0.75 | CYP1A2 (0.57) | CYP1A2CYP2C8CYP2B6KCNQ2KCNQ4 | |
| SCHEMBL31019994 | 0.74 | KCNQ3 (0.39) | CYP1A2KCNQ2KCNQ4KCNQ5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119948023-A | Regulator containing piperidine polycyclic derivative, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2025-05-06 | — | — | CN | disclosed |
| CN-118451079-A | Benzopiperidine derivative modulators, methods of preparation and uses thereof | 上海翰森生物医药科技有限公司 | 2024-08-06 | — | — | CN | disclosed |