Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MYC | P01106 | 1/20 | 0.48 |
| ▸ | MAX | P61244 | 1/20 | 0.48 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | CASP7 | P55210 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL64767 | 0.78 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL29376440 | 0.78 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL9326676 | 0.78 | MYC (0.52) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL11811408 | 0.77 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL11811414 | 0.77 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL13619177 | 0.77 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL29915189 | 0.77 | MYC (0.50) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL482375 | 0.75 | BACE1 (0.60) | MYCMAXNQO2CYP1A2KDM4E | |
| SCHEMBL6447066 | 0.75 | MYC (0.48) | MYCMAXTRPM4NQO2CYP1A2 | |
| SCHEMBL3070474 | 0.75 | CYP1A2 (0.64) | CYP1A2KDM4EHPGDALDH1A1SMN1; SMN2 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0497371-B1 | Pyrimidinyloxy(thio)quinoline derivatives, preparation process of the derivative, and agri-horticultural fungicide comprising the derivative as active ingredient | MITSUI CHEMICALS INC (JP) | 1998-06-24 | — | — | EP | claimed |
| EP-0497371-A1 | Pyrimidinyloxy(thio)quinoline derivatives, preparation process of the derivative, and agri-horticultural fungicide comprising the derivative as active ingredient | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1992-08-05 | — | — | EP | claimed |
| JP-6056823-A | — | — | None | — | — | JP | disclosed |
| JP-5271222-A | — | — | None | — | — | JP | disclosed |
| CN-108570004-A | A kind of compound that there is double action to 5-HT and its application in treating depression | 郝惠敏 | 2018-09-25 | — | — | CN | disclosed |
| EP-0497371-B1 | Pyrimidinyloxy(thio)quinoline derivatives, preparation process of the derivative, and agri-horticultural fungicide comprising the derivative as active ingredient | MITSUI CHEMICALS INC (JP) | 1998-06-24 | — | — | EP | disclosed |
| JP-H0656823-A | QUINOLINE DERIVATIVE HAVING ALKYLTHIO GROUP IN PYRIMIDINE RING, ITS PRODUCTION AND GERMICIDE FOR AGRICULTURE AND HORTICULTURE CONTAINING THE SAME DERIVATIVE AS ACTIVE INGREDIENT | MITSUI TOATSU CHEM INC | 1994-03-01 | — | — | JP | disclosed |
| JP-H05271222-A | PYRIMIDINYLOXY@(3754/24)THIO)QUINOLINE DERIVATIVE, ITS PRODUCTION AND AGRICULTURAL AND HORTICULTURAL GERMICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT | MITSUI TOATSU CHEM INC | 1993-10-19 | — | — | JP | disclosed |
| US-5202329-A | Pyrimidinyloxy(thio)quinoline derivative, and agri-horticultural fungicide comprising the derivative as active ingredient | MITSUI TOATSU CHEMICALS INC. (JP) | 1993-04-13 | — | — | US | disclosed |
| EP-0497371-A1 | Pyrimidinyloxy(thio)quinoline derivatives, preparation process of the derivative, and agri-horticultural fungicide comprising the derivative as active ingredient | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1992-08-05 | — | — | EP | disclosed |