⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL211613 | 1.00 | — | — | |
| SCHEMBL342957 | 0.82 | — | — | |
| SCHEMBL30706761 | 0.82 | — | — | |
| SCHEMBL1459949 | 0.79 | — | — | |
| SCHEMBL29546988 | 0.78 | HTT (0.50) | — | |
| SCHEMBL20043 | 0.78 | HTT (0.50) | — | |
| SCHEMBL1043573 | 0.77 | — | — | |
| SCHEMBL31133690 | 0.76 | HTT (0.48) | — | |
| SCHEMBL23704250 | 0.76 | CYP2A6 (0.59) | — | |
| SCHEMBL15334774 | 0.75 | TSHR (0.44) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3571198-B1 | BICYCLIC AMINES AS JAK KINASE INHIBITORS | LEO PHARMA AS (DK) | 2023-02-01 | — | — | EP | claimed |
| US-20240207238-A1 | INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE, COMPOSITIONS, AND METHODS OF USE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2024-06-27 | — | — | US | disclosed |
| EP-3571198-B1 | BICYCLIC AMINES AS JAK KINASE INHIBITORS | LEO PHARMA AS (DK) | 2023-02-01 | — | — | EP | disclosed |