Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL11273699 | 0.88 | MAPT (0.36) | MAPTALOX15TRPA1 | |
| SCHEMBL11273701 | 0.88 | MAPT (0.36) | MAPTALOX15TRPA1 | |
| Bromide SCHEMBL11517153 | 0.83 | MAPT (0.39) | MAPTALOX15TRPA1 | |
| Bromide SCHEMBL11437682 | 0.77 | MAPT (0.32) | MAPTALOX15 | |
| SCHEMBL11598464 | 0.74 | MAPT (0.48) | MAPTALOX15 | |
| SCHEMBL11598466 | 0.74 | MAPT (0.48) | MAPTALOX15 | |
| SCHEMBL11452097 | 0.73 | — | — | |
| SCHEMBL11432417 | 0.73 | FFAR1 (0.32) | — | |
| SCHEMBL11282134 | 0.69 | MAPT (0.65) | MAPTALOX15 | |
| SCHEMBL11451270 | 0.69 | MAPT (0.65) | MAPTALOX15 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4111992-A | SUBSTITUTED CYCLOHEXENONES | HOFFMANN-LA ROCHE INC. (US) | 1978-09-05 | — | — | US | claimed |
| US-4157345-A | INTERMEDIATE IN SYNTHESIS OF CANTHAXANTHIN | HOFFMANN-LA ROCHE INC. (US) | 1979-06-05 | — | — | US | disclosed |
| US-4153805-A | REACTING 1-(1-HYDROXY-2,6,6-TRIMETHYL-CYCLOHEX-2-EN-1-YL)-3-ALKOXY-3-METHYL-PENT-4-EN-1-YNE WITH AN ALKANOIC ACID | HOFFMANN-LA ROCHE INC. (US) | 1979-05-08 | — | — | US | disclosed |
| US-4111992-A | SUBSTITUTED CYCLOHEXENONES | HOFFMANN-LA ROCHE INC. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4088689-A | INTERMEDIATES FOR CANTHAXANTHIN | HOFFMANN-LA ROCHE INC. (US) | 1978-05-09 | — | — | US | disclosed |
| US-4045476-A | CANTHAXANTHIN INTERMEDIATES | HOFFMANN-LA ROCHE INC. (US) | 1977-08-30 | — | — | US | disclosed |
| US-4025564-A | FOOD COLORING AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1977-05-24 | — | — | US | disclosed |
| US-4000198-A | INTERMEDIATE FOR CANTHAXANTHIN | HOFFMANN-LA ROCHE INC. (US) | 1976-12-28 | — | — | US | disclosed |