⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28115000 | 0.78 | GAA (0.30) | — | |
| SCHEMBL28153175 | 0.73 | — | — | |
| SCHEMBL28130501 | 0.71 | — | — | |
| SCHEMBL28131220 | 0.71 | — | — | |
| SCHEMBL28158803 | 0.70 | ACHE (0.35) | — | |
| SCHEMBL28152947 | 0.70 | ACHE (0.35) | — | |
| Formic Acid SCHEMBL28869439 | 0.69 | CYP1A2 (0.34) | — | |
| SCHEMBL28317558 | 0.67 | CA12 (0.46) | — | |
| SCHEMBL29148229 | 0.67 | CYP1A2 (0.35) | — | |
| SCHEMBL29148253 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105532298-B | A kind of preparation method of blueberry potted-seedling transplanting matrix | 青岛沃林蓝莓果业有限公司 | 2019-03-29 | — | — | CN | disclosed |