Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 9/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Diethylamine SCHEMBL8852616 | 0.91 | PPARA (0.47) | PPARAEPHX2EPHX1 | |
| SCHEMBL1637970 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL6900968 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL9820362 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL6895971 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL6900990 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL6902266 | 0.89 | EPHX1 (0.62) | PPARAEPHX1 | |
| SCHEMBL19347270 | 0.84 | EPHX1 (0.52) | PPARAEPHX1 | |
| SCHEMBL23902967 | 0.84 | EPHX1 (0.71) | PPARAEPHX2EPHX1LPAR1 | |
| SCHEMBL22857766 | 0.84 | EPHX1 (0.71) | PPARAEPHX2EPHX1LPAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104188833-A | AQUEOUS COMPOSITION SUITABLE AS SHAMPOO | RHODIA OPERATIONS | 2014-12-10 | — | — | CN | disclosed |
| US-5290880-A | Catalytic polymerization of vinylformamide followed by hydrolysis | BASF AKTIENGESELLSCHAFT (DE) | 1994-03-01 | — | — | US | disclosed |
| US-5258473-A | Catalytic addition polymerization without surfactants | BASF AKTIENGESELLSCHAFT (DE) | 1993-11-02 | — | — | US | disclosed |