⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25594918 | 0.69 | — | — | |
| SCHEMBL20040985 | 0.58 | NOS2 (0.34) | — | |
| SCHEMBL25831365 | 0.56 | — | — | |
| SCHEMBL22416535 | 0.55 | — | — | |
| SCHEMBL20860641 | 0.54 | — | — | |
| SCHEMBL21089350 | 0.54 | — | — | |
| SCHEMBL18350284 | 0.52 | NOS3 (0.34) | — | |
| SCHEMBL22239432 | 0.51 | — | — | |
| SCHEMBL14398869 | 0.51 | — | — | |
| SCHEMBL14721494 | 0.51 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230167110-A1 | 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS | SCHRÖDINGER, INC. | 2023-06-01 | — | — | US | disclosed |