Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 2/20 | 0.74 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.70 |
| ▸ | PTGS1 | P23219 | 11/20 | 0.68 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL714636 | 1.00 | NR1H3 (0.74) | NR1H3PTPN1PTGS1CYP19A1 | |
| Acanthol SCHEMBL267115 | 0.85 | NR1H3 (1.00) | NR1H3PTPN1PTGS1 | |
| Acanthol SCHEMBL261846 | 0.85 | NR1H3 (1.00) | NR1H3PTPN1PTGS1 | |
| Acanthol SCHEMBL12450173 | 0.85 | NR1H3 (1.00) | NR1H3PTPN1PTGS1 | |
| SCHEMBL12522457 | 0.84 | NR1H3 (0.68) | NR1H3PTPN1PTGS1 | |
| SCHEMBL267871 | 0.84 | NR1H3 (0.68) | NR1H3PTPN1PTGS1 | |
| SCHEMBL262007 | 0.84 | NR1H3 (0.68) | NR1H3PTPN1PTGS1 | |
| SCHEMBL12450177 | 0.84 | NR1H3 (0.68) | NR1H3PTPN1PTGS1 | |
| Acanthoic Acid SCHEMBL12450156 | 0.82 | NR1H3 (1.00) | NR1H3PTPN1PTGS1 | |
| SCHEMBL260903 | 0.82 | NR1H3 (0.69) | NR1H3PTPN1PTGS1CYP19A1 |
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-115820759-B | Method for preparing enantiomer-rose alkane and enantiomer-pimarane skeleton compound | 北京大学深圳研究生院 | 2023-08-08 | — | — | CN | disclosed |
| CN-115820759-A | Method for preparing enantiomer-rosecane and enantiomer-pimaradine skeleton compounds | 北京大学深圳研究生院 | 2023-03-21 | — | — | CN | disclosed |