⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22624122 | 0.92 | CES2 (0.33) | — | |
| SCHEMBL20047559 | 0.86 | — | — | |
| SCHEMBL22624033 | 0.83 | — | — | |
| SCHEMBL22624072 | 0.79 | — | — | |
| SCHEMBL22623953 | 0.79 | — | — | |
| SCHEMBL22624022 | 0.78 | CES2 (0.32) | — | |
| SCHEMBL22623884 | 0.77 | — | — | |
| SCHEMBL18716557 | 0.77 | — | — | |
| SCHEMBL25101239 | 0.75 | CES2 (0.33) | — | |
| SCHEMBL22624007 | 0.75 | CES2 (0.33) | — |
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-20230142274-A1 | SUBSTITUTED ARYL COMPOUND | NANJING ZAIMING PHARMACEUTICAL CO., LTD. (CN) | 2023-05-11 | — | — | US | disclosed |
| US-20200347071-A1 | AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2020-11-05 | — | — | US | disclosed |