⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25374587 | 0.90 | ADORA1 (0.33) | — | |
| SCHEMBL25378992 | 0.77 | LMNA (0.40) | — | |
| SCHEMBL1229481 | 0.71 | DPP4 (0.40) | — | |
| SCHEMBL22122764 | 0.71 | HTR1A (0.34) | — | |
| SCHEMBL1229482 | 0.70 | — | — | |
| SCHEMBL22123758 | 0.68 | NNMT (0.36) | — | |
| SCHEMBL25378442 | 0.68 | NOS3 (0.37) | — | |
| SCHEMBL31248300 | 0.66 | — | — | |
| SCHEMBL14990136 | 0.63 | NNMT (0.46) | — | |
| SCHEMBL25347775 | 0.61 | CNR2 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4484426-A1 | PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG | Sunshine Lake Pharma Co., Ltd. (CN) | 2025-01-01 | — | — | EP | disclosed |