Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9309968 | 0.79 | TSHR (0.43) | CES2CES1AKR1B1 | |
| SCHEMBL22290905 | 0.71 | TSHR (0.40) | PKM | |
| SCHEMBL9825319 | 0.70 | — | — | |
| SCHEMBL604651 | 0.67 | AKR1B1 (0.38) | AKR1B1 | |
| SCHEMBL22639055 | 0.67 | — | — | |
| SCHEMBL600724 | 0.66 | — | — | |
| SCHEMBL30069192 | 0.66 | — | — | |
| SCHEMBL25338486 | 0.65 | TSHR (0.36) | — | |
| SCHEMBL28466306 | 0.65 | ALDH1A1 (0.42) | — | |
| Bicarbonate SCHEMBL9635818 | 0.64 | CES1 (0.54) | CES2CES1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115490708-B | Sulfonamide macrocyclic derivative, preparation method and application thereof | 苏州亚盛药业有限公司 | 2025-01-24 | — | — | CN | disclosed |