Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PPM1B | O75688 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Propylene Glycol SCHEMBL9893772 | 0.86 | PPM1B (0.42) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| SCHEMBL9938230 | 0.85 | TAAR1 (0.34) | TDP1 | |
| SCHEMBL1296712 | 0.79 | PPM1B (0.50) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| Propylene Glycol SCHEMBL16653131 | 0.79 | CHRM2 (0.36) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| Propylene Glycol SCHEMBL9894371 | 0.79 | CHRM2 (0.36) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| Ethylene Glycol SCHEMBL1297097 | 0.78 | PPM1B (0.46) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| SCHEMBL14204531 | 0.76 | PPM1B (0.50) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| SCHEMBL234736 | 0.73 | TP53 (0.50) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| SCHEMBL1245769 | 0.73 | TP53 (0.50) | PPM1BPTPN1PPP1CCTP53CYP3A4 | |
| SCHEMBL1245768 | 0.73 | TP53 (0.50) | PPM1BPTPN1PPP1CCTP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012082826-A1 | GLYCOL ETHER-BASED CYCLOHEXANOATE ESTERS, THEIR SYNTHESIS AND METHODS OF USE | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2012-06-21 | — | — | WO | disclosed |