Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 3/20 | 0.36 |
| ▸ | CPN1 | P15169 | 2/20 | 0.36 |
| ▸ | CPA1 | P15085 | 2/20 | 0.35 |
| ▸ | CPB1 | P15086 | 1/20 | 0.35 |
| ▸ | CPA3 | P15088 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28895368 | 0.84 | FOLH1 (0.42) | KDM4EALDH1A1TDP1FOLH1CPB2 | |
| SCHEMBL7279991 | 0.78 | CPB2 (0.48) | ALDH1A1TDP1FOLH1MMP2MMP9 | |
| SCHEMBL7279987 | 0.78 | CPB2 (0.48) | ALDH1A1TDP1FOLH1MMP2MMP9 | |
| SCHEMBL25660483 | 0.77 | KDM4E (0.41) | KDM4EALDH1A1TDP1GAAPOLB | |
| SCHEMBL3917900 | 0.77 | KDM4E (0.41) | KDM4EALDH1A1TDP1GAAPOLB | |
| SCHEMBL9185685 | 0.76 | KDM4E (0.45) | KDM4EALDH1A1TDP1GAAPOLB | |
| SCHEMBL23319669 | 0.75 | KDM4E (0.43) | KDM4EALDH1A1TDP1GAAPOLB | |
| SCHEMBL4603755 | 0.74 | MMP2 (0.51) | ALDH1A1FOLH1MMP2MMP9MMP12 | |
| SCHEMBL8757009 | 0.74 | MMP2 (0.48) | ALDH1A1TDP1FOLH1MMP2MMP9 | |
| SCHEMBL4603751 | 0.74 | MMP2 (0.51) | ALDH1A1FOLH1MMP2MMP9MMP12 |
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-112661882-B | Application of cyclohexene-1,2-dicarboxylic acid ester compound | 中国石油化工股份有限公司 | 2022-10-21 | — | — | CN | disclosed |