Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.38 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17424071 | 0.89 | CYP1A2 (0.58) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL17424081 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL17424063 | 0.83 | KDM4E (0.54) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL30353206 | 0.76 | KDM4E (0.64) | ALDH1A1HPGDKDM4ECYP1A2HTT | |
| SCHEMBL17424066 | 0.76 | CYP1A2 (0.59) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL8332461 | 0.75 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL17424078 | 0.75 | CYP1A2 (0.57) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL7509909 | 0.71 | KDM4E (0.57) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL30353210 | 0.70 | KDM4E (0.49) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 | |
| SCHEMBL19420102 | 0.70 | CYP1A2 (0.53) | ALDH1A1HPGDKDM4ECYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3166930-A1 | 4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXAMIDE AS SELECTIVE LIGAND FOR CANNABINOID RECEPTOR 2 FOR DIAGNOSIS AND THERAPY | ETH Zürich (CH) | 2017-05-17 | — | — | EP | disclosed |
| WO-2016005419-A1 | 4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXAMIDE AS SELECTIVE LIGAND FOR CANNABINOID RECEPTOR 2 FOR DIAGNOSIS AND THERAPY | ETH ZURICH (CH) | 2016-01-14 | — | — | WO | disclosed |