Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 16/20 | 0.37 |
| ▸ | THRA | P10827 | 14/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 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 | |
|---|---|---|---|---|
| SCHEMBL31301011 | 0.94 | THRB (0.39) | THRBTHRACYP2C8CYP2C9CA1 | |
| SCHEMBL25768632 | 0.93 | THRB (0.44) | THRBTHRACYP2C8CYP2C9MEN1 | |
| SCHEMBL31300999 | 0.93 | THRB (0.44) | THRBTHRACYP2C8CYP2C9MEN1 | |
| SCHEMBL30460706 | 0.89 | THRA (0.38) | THRBTHRACYP2C8CYP2C9CA1 | |
| SCHEMBL25768630 | 0.89 | THRA (0.38) | THRBTHRACYP2C8CYP2C9CA1 | |
| SCHEMBL25291901 | 0.89 | THRB (0.49) | THRBTHRACYP2C8CYP2C9SMN1; SMN2 | |
| SCHEMBL30460702 | 0.89 | THRB (0.49) | THRBTHRACYP2C8CYP2C9SMN1; SMN2 | |
| SCHEMBL30460752 | 0.88 | THRB (0.35) | THRBTHRACYP2C9DHODHKDM4E | |
| SCHEMBL25246799 | 0.88 | THRB (0.35) | THRBTHRACYP2C9DHODHKDM4E | |
| SCHEMBL30460697 | 0.85 | THRA (0.48) | THRBTHRACYP2C8CYP2C9SMN1; SMN2 |
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-4458820-A1 | CLASS OF QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2024-11-06 | — | — | EP | claimed |
| EP-4458820-A1 | CLASS OF QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2024-11-06 | — | — | EP | disclosed |
| CN-118871435-A | Quinoline compound, preparation method, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2024-10-29 | — | — | CN | disclosed |
| CN-116354934-A | Quinoline compound, preparation method, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2023-06-30 | — | — | CN | disclosed |