Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.53 |
| ▸ | TNKS | O95271 | 1/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10677317 | 0.93 | KDM4E (0.54) | ABCG2SIGMAR1KDM4E | |
| SCHEMBL10684580 | 0.82 | SIGMAR1 (0.52) | ABCG2SIGMAR1KDM4E | |
| SCHEMBL10682290 | 0.81 | MAOA (0.67) | SIGMAR1TNKSCYP19A1 | |
| SCHEMBL10682013 | 0.80 | MAP2K1 (0.54) | MAP2K1KDM4E | |
| SCHEMBL10683812 | 0.79 | CYP19A1 (0.54) | ABCG2SIGMAR1TNKSCYP19A1KDM4E | |
| SCHEMBL10486553 | 0.78 | TNKS (0.61) | ABCG2SIGMAR1TNKSCYP19A1KDM4E | |
| SCHEMBL10682295 | 0.78 | CYP3A4 (0.64) | ABCG2SIGMAR1TNKSCYP19A1KDM4E | |
| SCHEMBL10677643 | 0.78 | CYP19A1 (0.55) | ABCG2SIGMAR1TNKSCYP19A1 | |
| SCHEMBL10681965 | 0.77 | MEN1 (0.57) | TNKSCYP19A1 | |
| SCHEMBL10679051 | 0.77 | CYP19A1 (0.51) | ABCG2SIGMAR1TNKSCYP19A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4780478-A | Aminopropoxy-chromones useful as antidepressants | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKTER HAFTUNG (DE) | 1988-10-25 | — | — | US | disclosed |
| US-4508732-A | Basic ethers useful as antidepressant agents | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-04-02 | — | — | US | disclosed |
| EP-0031885-B1 | BASIC ETHERS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION | MERCK PATENT GmbH (DE) | 1984-06-27 | — | — | EP | disclosed |
| US-4376123-A | Hexahydroazepinyloxy-chromones useful as antidepressants | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-03-08 | — | — | US | disclosed |
| EP-0031885-A1 | Basic ethers, pharmaceutical compositions containing them and process for their preparation | MERCK PATENT GmbH (DE) | 1981-07-15 | — | — | EP | disclosed |