Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | KDM1A | O60341 | 2/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.39 |
| ▸ | GCK | P35557 | 1/20 | 0.39 |
| ▸ | GCKR | Q14397 | 1/20 | 0.39 |
| ▸ | TEK | Q02763 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3387516 | 1.00 | KIF11 (0.51) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| Hydrochloric Acid SCHEMBL31453978 | 0.98 | KIF11 (0.50) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL1550000 | 0.90 | CYP11B1 (0.49) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| Hydrochloric Acid SCHEMBL31375590 | 0.89 | CYP11B1 (0.48) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL30767444 | 0.87 | KIF11 (0.40) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL27344645 | 0.86 | KIF11 (0.63) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL14037163 | 0.85 | KIF11 (0.52) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL29690424 | 0.84 | KIF11 (0.61) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL28530523 | 0.84 | KIF11 (0.61) | KIF11CYP11B1CYP11B2MAOBKDM1A | |
| SCHEMBL8239616 | 0.83 | KIF11 (0.51) | KIF11CYP11B1CYP11B2MAOBKDM1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4568959-A1 | BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2025-06-18 | — | — | EP | disclosed |
| CN-119677733-A | Bicyclic tetrahydrothiazepine derivatives | 豪夫迈·罗氏有限公司 | 2025-03-21 | — | — | CN | disclosed |
| CN-118660872-A | Pyrimidine compound, preparation method and medical application thereof | 江苏亚虹医药科技股份有限公司 | 2024-09-17 | — | — | CN | disclosed |
| CN-116496252-A | Pyrimidine compound, preparation method and medical application thereof | 江苏亚虹医药科技股份有限公司 | 2023-07-28 | — | — | CN | disclosed |