Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.75 |
| ▸ | HPGD | P15428 | 2/20 | 0.75 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.75 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.75 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.75 |
| ▸ | SNCA | P37840 | 2/20 | 0.62 |
| ▸ | PKM | P14618 | 2/20 | 0.62 |
| ▸ | CA12 | O43570 | 1/20 | 0.62 |
| ▸ | CA1 | P00915 | 1/20 | 0.62 |
| ▸ | CA2 | P00918 | 1/20 | 0.62 |
| ▸ | CA3 | P07451 | 1/20 | 0.62 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.62 |
| ▸ | CA4 | P22748 | 1/20 | 0.62 |
| ▸ | CA6 | P23280 | 1/20 | 0.62 |
| ▸ | CA5A | P35218 | 1/20 | 0.62 |
| ▸ | CA7 | P43166 | 1/20 | 0.62 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.62 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL29484671 | 0.94 | KDM4E (0.75) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL28952364 | 0.90 | SMN1; SMN2 (0.60) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL28952366 | 0.90 | SMN1; SMN2 (0.60) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL81317 | 0.86 | KDM4E (1.00) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL29636389 | 0.86 | KDM4E (1.00) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL81318 | 0.86 | KDM4E (1.00) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL27858762 | 0.85 | KDM4E (0.97) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL27858763 | 0.85 | KDM4E (0.97) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| O,O'-Dimethylcaffeic Acid SCHEMBL28025225 | 0.85 | KDM4E (0.97) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL28893560 | 0.82 | CA12 (0.73) | KDM4EALDH1A1HPGDCA12CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115368239-B | Synthesis and pharmaceutical application of cinnamate derivative | 南开大学 | 2024-04-26 | — | — | CN | disclosed |
| CN-115368239-A | Synthesis of cinnamate derivative and pharmaceutical application thereof | 南开大学 | 2022-11-22 | — | — | CN | disclosed |