⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24309125 | 0.86 | — | — | |
| SCHEMBL681147 | 0.79 | GRIN2D (0.31) | — | |
| SCHEMBL21577695 | 0.79 | GRIN2D (0.38) | — | |
| SCHEMBL23073854 | 0.76 | — | — | |
| SCHEMBL680662 | 0.74 | GRIN2D (0.36) | — | |
| SCHEMBL21555139 | 0.74 | — | — | |
| SCHEMBL23278031 | 0.74 | GRIN2D (0.37) | — | |
| SCHEMBL20434844 | 0.74 | — | — | |
| SCHEMBL24835712 | 0.73 | — | — | |
| SCHEMBL21191637 | 0.72 | CNR2 (0.31) | — |
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-20180118751-A1 | IMIDAZOPYRAZINES AND PYRAZOLOPYRIMIDINES AND THEIR USE AS AMPA RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-03 | — | — | US | disclosed |