Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13714227 | 1.00 | TRPV1 (0.50) | TRPV1CNR1CNR2 | |
| SCHEMBL14287821 | 0.95 | ALDH1A1 (0.49) | TRPV1 | |
| SCHEMBL10089397 | 0.79 | CNR1 (0.59) | CNR1CNR2 | |
| SCHEMBL6481615 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL13870527 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL6440246 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL12555493 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL6440780 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL6437016 | 0.75 | EPHX1 (0.73) | — | |
| SCHEMBL6481619 | 0.75 | EPHX1 (0.73) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7576235-B2 | a monoalcohol reactant of the formula R1 OH, a diisocyanate reactant of the formula OCN R2 NCO and a Lewis acid catalyst then adding to the reaction mixture a diamine ; high yield and purity | XEROX CORPORATION (US) | 2009-08-18 | — | — | US | disclosed |
| US-7314949-B2 | 1,2-bis(6-(ethylhexyloxycarbonylamino)hexylaminocarbonylamino)cyclohexane; gelling agents for hot melt and phase change inks | XEROX CORPORATION (US) | 2008-01-01 | — | — | US | disclosed |