⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23423705 | 0.82 | NSD2 (0.33) | — | |
| SCHEMBL26618311 | 0.81 | DRD2 (0.31) | — | |
| SCHEMBL27276861 | 0.79 | — | — | |
| SCHEMBL5986972 | 0.76 | HTT (0.38) | — | |
| SCHEMBL12196869 | 0.76 | — | — | |
| SCHEMBL15794194 | 0.76 | — | — | |
| SCHEMBL23712104 | 0.75 | SLC6A4 (0.36) | — | |
| SCHEMBL27413219 | 0.75 | PIK3CD (0.39) | — | |
| SCHEMBL25379400 | 0.75 | — | — | |
| SCHEMBL23781833 | 0.72 | — | — |
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-2024081311-A1 | CBL-B MODULATORS AND USES THEREOF | NIMBUS CLIO, INC. (US) | 2024-04-18 | — | — | WO | disclosed |