Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.57 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ICMT | O60725 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | MPO | P05164 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | JUN | P05412 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31164712 | 1.00 | MTNR1A (0.57) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL22499949 | 0.86 | KEAP1 (0.68) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL9751552 | 0.81 | CA2 (0.56) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL6202916 | 0.81 | KEAP1 (0.75) | CA2KEAP1NFE2L2SMN1; SMN2CYP2A6 | |
| SCHEMBL28563290 | 0.81 | CYP2A6 (0.64) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL8605628 | 0.79 | MTNR1A (0.59) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL31164737 | 0.79 | MTNR1A (0.54) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL10982992 | 0.79 | MTNR1A (0.54) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL4605763 | 0.78 | CYP2A6 (0.64) | MTNR1AMTNR1BCA2KEAP1NFE2L2 | |
| SCHEMBL6003503 | 0.78 | MTNR1A (0.60) | MTNR1AMTNR1BCA2KEAP1NFE2L2 |
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-2025122501-A1 | BENZOTHIOPHENE-3-YL- AND BENZOSELENOPHENE-3-YL (BICLYCLIC HETEROARYL) MALEMIDES AS GSK-3 INHIBITORS | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2025-06-12 | — | — | WO | disclosed |
| CN-108264509-B | Substituted benzothieno [2,3-c ] tetrahydropyridine derivatives, preparation method and application thereof | 复旦大学 | 2021-05-04 | — | — | CN | disclosed |