⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23494152 | 0.77 | TET2 (0.42) | — | |
| SCHEMBL17424317 | 0.75 | — | — | |
| SCHEMBL10287160 | 0.74 | ALDH1A1 (0.52) | — | |
| SCHEMBL11533113 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL2741140 | 0.70 | FFAR1 (0.33) | — | |
| SCHEMBL13564557 | 0.69 | ALDH1A1 (0.47) | — | |
| SCHEMBL11831021 | 0.68 | — | — | |
| SCHEMBL20489968 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL28486250 | 0.68 | ALDH1A1 (0.52) | — | |
| SCHEMBL23019589 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220017550-A1 | 3-PYRROLIDINE-INDOLE DERIVATIVES AS SEROTONERGIC PSYCHEDELIC AGENTS FOR THE TREATMENT OF CNS DISORDERS | MINDSET PHARMA INC. (CA) | 2022-01-20 | — | — | US | disclosed |