Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 18/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7973695 | 0.79 | MAPT (0.61) | VCAM1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30729425 | 0.78 | MAPT (0.59) | VCAM1ALDH1A1 | |
| SCHEMBL28948636 | 0.76 | VCAM1 (0.42) | VCAM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL28496545 | 0.72 | HCAR3 (0.52) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL27521426 | 0.71 | VCAM1 (0.53) | VCAM1ALDH1A1 | |
| SCHEMBL11875032 | 0.70 | VCAM1 (0.53) | VCAM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL10891021 | 0.69 | VCAM1 (0.51) | VCAM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL22708732 | 0.69 | VCAM1 (0.60) | VCAM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL14574954 | 0.69 | VCAM1 (0.54) | VCAM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11676842 | 0.68 | ALDH1A1 (0.48) | VCAM1ALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112105601-B | Benzenesulfonamide derivatives and related FERROSTATIN-1 analogs as cell death inhibitors | 维伯VZW公司 | 2022-11-18 | — | — | CN | disclosed |