Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29626008 | 0.77 | ALDH1A1 (0.53) | ALDH1A1ALOX15MEN1KMT2AMAPT | |
| SCHEMBL19717960 | 0.77 | ALDH1A1 (0.53) | ALDH1A1ALOX15MEN1KMT2AMAPT | |
| SCHEMBL214415 | 0.77 | ALDH1A1 (0.53) | ALDH1A1ALOX15MEN1KMT2AMAPT | |
| SCHEMBL11701598 | 0.76 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2A | |
| SCHEMBL5042652 | 0.74 | FNTA (0.44) | — | |
| SCHEMBL29179222 | 0.74 | ALDH1A1 (0.34) | ALDH1A1ALOX15CYP1B1MEN1KMT2A | |
| SCHEMBL8780535 | 0.73 | ALDH1A1 (0.42) | ALDH1A1ALOX15CYP1B1MEN1KMT2A | |
| SCHEMBL10812465 | 0.70 | FNTA (0.56) | ALDH1A1ALOX15MEN1KMT2AMAPT | |
| SCHEMBL10812462 | 0.70 | FNTA (0.56) | ALDH1A1ALOX15MEN1KMT2AMAPT | |
| SCHEMBL10708005 | 0.70 | CES2 (0.33) | ALDH1A1ALOX15CYP1B1 |
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-4031161-A | Process for producing mixture containing 4-(4'-methyl-4'-hydroxyamyl)-Δ3 -cyclohexene carboxaldehyde | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-06-21 | — | — | US | disclosed |
| US-4007137-A | Process for producing mixture containing 4-(4-methyl-4-hydroxyamyl)Δ3 -cyclohexenecarboxaldehyde, product produced, and its perfume uses | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-02-08 | — | — | US | disclosed |