Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | EBP | Q15125 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117522 | 0.99 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL30506420 | 0.87 | MEN1 (0.63) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL25304726 | 0.85 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL7192880 | 0.82 | CYP3A4 (0.63) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL30506419 | 0.79 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL21275479 | 0.79 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL30002388 | 0.79 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL2874467 | 0.79 | CYP3A4 (0.67) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL7901522 | 0.77 | CYP3A4 (0.65) | CYP3A4CYP2D6CYP2C19USP2MAPK1 | |
| SCHEMBL13002149 | 0.77 | FFAR1 (0.63) | CYP3A4NFKB1NFKB2RELAKMT2A |
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-1995025731-A1 | NOVEL 3-(φ-(4-BENZOYLPIPERIDINO)ALKYL)-4H-BENZOPYRAN-4-ONES, PREPARATION AND THERAPEUTICAL USE THEREOF | PIERRE FABRE MEDICAMENT (FR) | 1995-09-28 | — | — | WO | disclosed |