Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 8/20 | 0.37 |
| ▸ | LMNA | P02545 | 5/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | EED | O75530 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 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 | |
|---|---|---|---|---|
| SCHEMBL30487385 | 1.00 | KCNQ2 (0.46) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL25245702 | 0.85 | KCNQ2 (0.48) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL30487391 | 0.85 | KCNQ2 (0.48) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL25244695 | 0.84 | KCNQ2 (0.53) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL25285856 | 0.83 | KCNQ2 (0.47) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL31546537 | 0.83 | KCNQ2 (0.50) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL25243902 | 0.83 | KCNQ2 (0.46) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL30487409 | 0.83 | KCNQ2 (0.46) | KCNQ2RAB9AMAOBMAPTLMNA | |
| SCHEMBL31020115 | 0.83 | KCNQ2 (0.47) | KCNQ2RAB9AMAOBMAPTHTT | |
| SCHEMBL25290650 | 0.83 | KCNQ2 (0.47) | KCNQ2RAB9AMAOBMAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |