Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.71 |
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Metacresol SCHEMBL28026685 | 0.88 | ACHE (0.71) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Phenol SCHEMBL28146321 | 0.88 | ACHE (0.58) | ACHETSHRCYP1A2CYP2C19CA12 | |
| Toluene SCHEMBL27882805 | 0.88 | TSHR (0.71) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL27893633 | 0.87 | ACHE (0.85) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL2535890 | 0.87 | ACHE (0.85) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL8390202 | 0.87 | ACHE (0.85) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL11749131 | 0.87 | ACHE (0.85) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL6234380 | 0.87 | ACHE (0.94) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL7619164 | 0.85 | ACHE (0.81) | ACHETSHRCYP1A2CYP2C19CYP3A4 | |
| Metacresol SCHEMBL2314567 | 0.84 | ACHE (1.00) | ACHETSHRCYP1A2CYP2C19CYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117902967-A | Synthesis method of m-phenoxy benzaldehyde | 江苏格涞思工业科技集团有限公司 | 2024-04-19 | — | — | CN | disclosed |
| CN-117343316-A | Nylon 12 resin, preparation method and application thereof | 万华化学集团股份有限公司 | 2024-01-05 | — | — | CN | disclosed |
| CN-107710338-A | Partial discharge resistant electrically insulating resin composition | 住友精化株式会社 | 2018-02-16 | — | — | CN | disclosed |
| CN-107710339-A | Partial discharge resistant electrically insulating resin composition | 住友精化株式会社 | 2018-02-16 | — | — | CN | disclosed |
| US-5753407-A | Polyamic acid composition | KABUSHIKI KAISHA TOSHIBA (JP) | 1998-05-19 | — | — | US | disclosed |