⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6526251 | 0.71 | — | — | |
| SCHEMBL312460 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL10736530 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL1938631 | 0.70 | — | — | |
| SCHEMBL1684202 | 0.67 | — | — | |
| SCHEMBL4422067 | 0.67 | — | — | |
| SCHEMBL7443218 | 0.67 | — | — | |
| SCHEMBL8616381 | 0.67 | — | — | |
| SCHEMBL309070 | 0.67 | — | — | |
| SCHEMBL4575793 | 0.67 | LYN (0.37) | — |
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-2022272060-A1 | EP2 ANTAGONIST COMPOUNDS | RESERVOIR NEUROSCIENCE, INC. (US) | 2022-12-29 | — | — | WO | disclosed |