Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | TLR4 | O00206 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL535761 | 0.68 | LMNA (0.46) | TLR4 | |
| SCHEMBL27539994 | 0.67 | TLR4 (0.42) | TLR4 | |
| SCHEMBL3622979 | 0.67 | MCL1 (0.42) | TLR4 | |
| SCHEMBL26679308 | 0.65 | MAPK1 (0.40) | TLR4 | |
| SCHEMBL10740534 | 0.65 | NAAA (0.47) | — | |
| SCHEMBL15015958 | 0.65 | CA12 (0.38) | TLR4 | |
| SCHEMBL5896955 | 0.65 | MAPK1 (0.40) | TLR4 | |
| SCHEMBL535116 | 0.64 | HSD17B10 (0.43) | TLR4 | |
| SCHEMBL9862358 | 0.64 | ALDH1A1 (0.32) | CCR6 | |
| SCHEMBL2421576 | 0.64 | FAAH (0.34) | CCR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5283237-A | Use in perfumery of 2(1-vinyl-5-hexenyl) cyclopentanone, a process for preparing same, and process intermediates | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1994-02-01 | — | — | US | disclosed |