⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL9219002 | 1.00 | — | — | |
| SCHEMBL3695254 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL36621 | 0.75 | ALDH1A1 (0.39) | — | |
| SCHEMBL2058364 | 0.73 | — | — | |
| SCHEMBL2058362 | 0.73 | — | — | |
| SCHEMBL852141 | 0.69 | — | — | |
| SCHEMBL852140 | 0.69 | — | — | |
| SCHEMBL852156 | 0.69 | — | — | |
| SCHEMBL3283110 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL22167584 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116375622-A | Method for in-situ synthesis of vitamin A based on farnesene fermentation broth and application of method | 中国科学院青岛生物能源与过程研究所 | 2023-07-04 | — | — | CN | claimed |
| CN-116375622-A | Method for in-situ synthesis of vitamin A based on farnesene fermentation broth and application of method | 中国科学院青岛生物能源与过程研究所 | 2023-07-04 | — | — | CN | disclosed |
| US-5250710-A | Dihydropyran derivatives, processes for preparation and use | RHONE-POULENC NUTRITION ANIMALE (FR) | 1993-10-05 | — | — | US | disclosed |
| US-5157133-A | Vitamin A and E precursors | RHONE-POULENC NUTRITION ANIMALE (FR) | 1992-10-20 | — | — | US | disclosed |