Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 16/20 | 0.44 |
| ▸ | CNR2 | P34972 | 10/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5202867 | 0.91 | CNR1 (0.45) | TRPA1CNR1CNR2HDAC4 | |
| SCHEMBL5201399 | 0.90 | TRPA1 (0.46) | TRPA1CNR1CNR2HDAC4 | |
| SCHEMBL4825539 | 0.84 | CNR1 (0.61) | CNR1CNR2 | |
| SCHEMBL5206175 | 0.83 | HDAC4 (0.48) | CNR1CNR2HDAC4 | |
| SCHEMBL5202925 | 0.82 | CNR1 (0.48) | CNR1CNR2 | |
| SCHEMBL5200398 | 0.82 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2TRPA1CNR1MAPK1 | |
| SCHEMBL5202699 | 0.81 | CNR1 (0.44) | CNR1CNR2 | |
| SCHEMBL5206207 | 0.79 | CNR1 (0.51) | CNR1CNR2 | |
| SCHEMBL5203380 | 0.77 | HDAC4 (0.42) | SMN1; SMN2TRPA1CNR1CNR2HDAC4 | |
| Hydrochloric Acid SCHEMBL5202674 | 0.77 | CNR1 (0.46) | CNR1CNR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1490043-A4 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO INC (US) | 2007-05-30 | — | — | EP | disclosed |
| EP-1490043-A2 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2004-12-29 | — | — | EP | disclosed |
| WO-2003082190-A2 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2003-10-09 | — | — | WO | disclosed |