⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19360207 | 0.85 | — | — | |
| SCHEMBL19360218 | 0.81 | CHRNA7 (0.35) | — | |
| SCHEMBL19362376 | 0.80 | CYP2D6 (0.30) | — | |
| SCHEMBL19360195 | 0.75 | JUN (0.35) | — | |
| SCHEMBL19360204 | 0.74 | — | — | |
| SCHEMBL19360214 | 0.72 | JUN (0.34) | — | |
| SCHEMBL19349909 | 0.71 | JUN (0.35) | — | |
| SCHEMBL19349849 | 0.69 | JUN (0.34) | — | |
| SCHEMBL19360202 | 0.66 | CHRNA7 (0.43) | — | |
| SCHEMBL19360217 | 0.66 | CHRNA7 (0.30) | — |
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-20170267679-A1 | TRICYCLIC FUSED PYRIMIDINE COMPOUNDS AS INHIBITORS OF p97 COMPLEX | CLEAVE BIOSCIENCES INC (US) | 2017-09-21 | — | — | US | disclosed |