⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25489223 | 0.81 | — | — | |
| SCHEMBL14543081 | 0.80 | — | — | |
| SCHEMBL20307379 | 0.79 | — | — | |
| SCHEMBL11893262 | 0.79 | — | — | |
| SCHEMBL25667276 | 0.77 | — | — | |
| SCHEMBL17487308 | 0.77 | — | — | |
| SCHEMBL24996382 | 0.76 | MAPT (0.50) | — | |
| SCHEMBL14318002 | 0.74 | — | — | |
| SCHEMBL19354887 | 0.74 | — | — | |
| SCHEMBL22507542 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3180342-B1 | PYRROLO[3,2-D]PYRIMIDINE-2,4(3H,5H)-DIONE DERIVATIVES | HYDRA BIOSCIENCES INC (US) | 2019-06-26 | — | — | EP | disclosed |