Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 13/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 3/20 | 0.33 |
| ▸ | TACR3 | P29371 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6963331 | 0.85 | TACR1 (0.40) | TACR1TACR3 | |
| SCHEMBL7487168 | 0.74 | TACR1 (0.49) | TACR1 | |
| SCHEMBL7476736 | 0.74 | TACR1 (0.49) | TACR1 | |
| SCHEMBL6959274 | 0.72 | TACR1 (0.55) | TACR1TACR3 | |
| SCHEMBL2257887 | 0.68 | ESR2 (0.62) | ESR2 | |
| SCHEMBL6957734 | 0.63 | TACR1 (0.62) | TACR1TACR3 | |
| SCHEMBL23224353 | 0.63 | PTGER4 (0.44) | — | |
| SCHEMBL6483987 | 0.62 | TACR1 (0.67) | TACR1TACR3 | |
| SCHEMBL6482147 | 0.62 | TACR1 (0.67) | TACR1TACR3 | |
| SCHEMBL6483982 | 0.62 | TACR1 (0.67) | TACR1TACR3 |
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-1286978-A1 | CYCLOHEXYL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 2003-03-05 | — | — | EP | disclosed |
| WO-2001087866-A1 | CYCLOHEXYL DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 2001-11-22 | — | — | WO | disclosed |