Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 13/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7891977 | 1.00 | CYP19A1 (0.44) | CYP19A1KIF11CYP26A1CNR1HTT | |
| Bromide SCHEMBL7885638 | 0.99 | CYP19A1 (0.43) | CYP19A1KIF11CYP26A1CNR1HTT | |
| Bromide SCHEMBL7885634 | 0.99 | CYP19A1 (0.43) | CYP19A1KIF11CYP26A1CNR1HTT | |
| SCHEMBL27426144 | 0.88 | CYP19A1 (0.44) | CYP19A1CYP26A1STSCYP3A4CYP11B1 | |
| SCHEMBL10102654 | 0.84 | CYP19A1 (0.40) | CYP19A1CYP26A1 | |
| SCHEMBL7885484 | 0.83 | CYP19A1 (0.40) | CYP19A1KIF11HTTCYP3A4CYP2C19 | |
| SCHEMBL7893117 | 0.79 | CYP19A1 (0.43) | CYP19A1CYP26A1STSCYP11B1 | |
| SCHEMBL7895319 | 0.79 | CYP19A1 (0.43) | CYP19A1CYP26A1STSCYP3A4CYP11B1 | |
| SCHEMBL7896641 | 0.78 | KIF11 (0.50) | KIF11CNR1AR | |
| SCHEMBL7893758 | 0.78 | KIF11 (0.50) | KIF11CNR1ARMGLL |
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-1085668-C | 6 -[triazolyl [3 -(trifluoromethyl) phenyl]methyl] -2 -quinolinones and quinolinethiones | JANSSN PHARMACEUTICAL N V (BE) | 2002-05-29 | — | — | CN | claimed |
| EP-0800524-B1 | 6-[TRIAZOLYL[ 3-(TRIFLUOROMETHYL)PHENYL]METHYL]-2-QUINOLINONES AND -QUINOLINETHIONES | JANSSEN PHARMACEUTICA NV (BE) | 2001-10-31 | — | — | EP | claimed |
| CN-1085668-C | 6 -[triazolyl [3 -(trifluoromethyl) phenyl]methyl] -2 -quinolinones and quinolinethiones | JANSSN PHARMACEUTICAL N V (BE) | 2002-05-29 | — | — | CN | disclosed |
| EP-0800524-B1 | 6-[TRIAZOLYL[ 3-(TRIFLUOROMETHYL)PHENYL]METHYL]-2-QUINOLINONES AND -QUINOLINETHIONES | JANSSEN PHARMACEUTICA NV (BE) | 2001-10-31 | — | — | EP | disclosed |
| CN-1171789-A | 6- [ triazolyl [ 3- (trifluoromethyl) phenyl ] methyl ] -2-quinolinone and quinolinethione | JANSSEN PHARMACEUTICA NV (BE) | 1998-01-28 | — | — | CN | disclosed |