⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4576811 | 0.70 | — | — | |
| SCHEMBL14079969 | 0.70 | — | — | |
| SCHEMBL9436102 | 0.67 | — | — | |
| SCHEMBL20067531 | 0.67 | — | — | |
| SCHEMBL25762048 | 0.65 | ALDH1A1 (0.54) | — | |
| SCHEMBL22825579 | 0.65 | EGFR (0.43) | — | |
| SCHEMBL619182 | 0.64 | ALDH1A1 (0.42) | — | |
| SCHEMBL619181 | 0.64 | ALDH1A1 (0.42) | — | |
| SCHEMBL1015493 | 0.63 | — | — | |
| SCHEMBL9715091 | 0.63 | CNR2 (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025040089-A1 | NOVEL HETEROCYCLIC COMPOUND FOR SELECTIVELY REGULATING CANNABINOID CB1 FUNCTION | 德睿智药(苏州)新药研发有限公司 | 2025-02-27 | — | — | WO | disclosed |