⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27902176 | 0.78 | CTH (0.33) | — | |
| SCHEMBL3337079 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL11116684 | 0.77 | ALOX15 (0.33) | — | |
| SCHEMBL31589297 | 0.76 | HCAR2 (0.35) | — | |
| SCHEMBL7793498 | 0.74 | — | — | |
| SCHEMBL28960605 | 0.73 | ALDH1A1 (0.47) | — | |
| SCHEMBL995487 | 0.72 | ALOX15 (0.36) | — | |
| SCHEMBL11061010 | 0.72 | ALOX15 (0.36) | — | |
| SCHEMBL27906557 | 0.72 | ALOX15 (0.36) | — | |
| SCHEMBL24160467 | 0.72 | CHRM1 (0.47) | — |
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-110709700-A | Method for evaluating cell surface glycosylation | 朱诺治疗学股份有限公司 | 2020-01-17 | — | — | CN | disclosed |