Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL468223 | 1.00 | ALDH1A1 (0.32) | ALDH1A1CNR1CNR2TRPA1TRPV1 | |
| SCHEMBL468225 | 1.00 | ALDH1A1 (0.32) | ALDH1A1CNR1CNR2TRPA1TRPV1 | |
| SCHEMBL16506576 | 0.83 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL16506578 | 0.83 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL28583659 | 0.77 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL1190808 | 0.75 | — | — | |
| SCHEMBL11388076 | 0.75 | — | — | |
| SCHEMBL11650382 | 0.75 | — | — | |
| SCHEMBL310856 | 0.74 | — | — | |
| SCHEMBL29000478 | 0.72 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006060885-A1 | 7-(2-CYCLOHEXYLIDENE-ETHYLIDENE)-SPIRO[5.5]UNDECANES USEFUL FOR MAKING PHARMACEUTICAL COMPOSITIONS | K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) | 2006-06-15 | — | — | WO | disclosed |