⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21999426 | 0.83 | — | — | |
| SCHEMBL22000111 | 0.78 | ESR2 (0.30) | — | |
| SCHEMBL18975917 | 0.72 | FFAR1 (0.30) | — | |
| SCHEMBL21729587 | 0.70 | LPL (0.38) | — | |
| SCHEMBL1075777 | 0.64 | LPL (0.41) | — | |
| SCHEMBL10041652 | 0.61 | LPL (0.46) | — | |
| SCHEMBL23053820 | 0.61 | JAK2 (0.32) | — | |
| SCHEMBL23043019 | 0.61 | JAK2 (0.39) | — | |
| SCHEMBL25406099 | 0.61 | FFAR1 (0.33) | — | |
| SCHEMBL462939 | 0.61 | JAK2 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11045455-B2 | Azetidine derivative, preparation method therefor, and use thereof | SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) | 2021-06-29 | — | — | US | disclosed |
| US-20200147062-A1 | AZETIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) | 2020-05-14 | — | — | US | disclosed |