⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23183460 | 0.82 | KDM4E (0.48) | — | |
| SCHEMBL23183403 | 0.71 | KDM4E (0.32) | — | |
| SCHEMBL20350858 | 0.68 | ALDH1A1 (0.47) | — | |
| SCHEMBL20339837 | 0.64 | KDM4E (0.57) | — | |
| SCHEMBL23183409 | 0.59 | ALDH1A1 (0.41) | — | |
| SCHEMBL28160957 | 0.56 | SLC6A2 (0.40) | — | |
| SCHEMBL4196229 | 0.55 | KDM4E (0.38) | — | |
| SCHEMBL10346285 | 0.55 | DRD2 (0.33) | — | |
| Morpholine SCHEMBL4918666 | 0.55 | KDM4E (0.44) | — | |
| SCHEMBL612910 | 0.55 | DRD2 (0.32) | — |
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-11780812-B2 | Oxopyridine derivatives useful as aminocarboxymuconate semialdehyde decarboxylase (ACMSD) inhibitors | ORSOBIO, INC. (US) | 2023-10-10 | — | — | US | disclosed |
| US-20210094916-A1 | OXOPYRIDINE DERIVATIVES USEFUL AS AMINOCARBOXYMUCONATE SEMIALDEHYDE DECARBOXYLASE (ACMSD) INHIBITORS | ORSOBIO, INC. | 2021-04-01 | — | — | US | disclosed |