⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10005358 | 0.76 | — | — | |
| SCHEMBL12391410 | 0.72 | — | — | |
| SCHEMBL791613 | 0.72 | — | — | |
| SCHEMBL6366181 | 0.65 | CRBN (0.39) | — | |
| SCHEMBL15722726 | 0.65 | — | — | |
| SCHEMBL14268181 | 0.64 | PIK3CD (0.41) | — | |
| SCHEMBL13204359 | 0.63 | — | — | |
| SCHEMBL12748060 | 0.62 | — | — | |
| SCHEMBL15930575 | 0.62 | DRD1 (0.43) | — | |
| SCHEMBL17584876 | 0.62 | — | — |
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-2018098208-A1 | NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |