⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23992079 | 0.76 | EPHX1 (0.44) | — | |
| SCHEMBL23992110 | 0.70 | EPHX1 (0.56) | — | |
| SCHEMBL23992101 | 0.70 | HSD11B1 (0.38) | — | |
| SCHEMBL23992105 | 0.70 | THRB (0.36) | — | |
| SCHEMBL23992016 | 0.69 | — | — | |
| SCHEMBL23992210 | 0.69 | SCN9A (0.32) | — | |
| SCHEMBL23933226 | 0.68 | DGAT1 (0.39) | — | |
| SCHEMBL23933228 | 0.68 | DGAT1 (0.39) | — | |
| SCHEMBL23933227 | 0.68 | DGAT1 (0.39) | — | |
| SCHEMBL23992123 | 0.66 | CHRNA7 (0.38) | — |
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-2021217040-A1 | CARBAMATE AND UREA DERIVATIVES | IMMVENTION THERAPEUTIX (US) | 2021-10-28 | — | — | WO | disclosed |