⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25824240 | 0.88 | ADRA1A (0.34) | — | |
| SCHEMBL24004026 | 0.83 | HTR1D (0.35) | — | |
| SCHEMBL23999358 | 0.77 | FLT3 (0.36) | — | |
| SCHEMBL25820202 | 0.76 | HTR2A (0.47) | — | |
| SCHEMBL26330032 | 0.74 | IRAK4 (0.34) | — | |
| SCHEMBL25831641 | 0.71 | EHMT2 (0.38) | — | |
| SCHEMBL24006324 | 0.70 | SIGMAR1 (0.41) | — | |
| SCHEMBL24003945 | 0.68 | — | — | |
| SCHEMBL23999787 | 0.67 | — | — | |
| SCHEMBL25457185 | 0.67 | HTR2A (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021226477-A1 | AKT3 MODULATORS | GEORGIAMUNE LLC (US) | 2021-11-11 | — | — | WO | disclosed |