⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24880348 | 0.74 | — | — | |
| SCHEMBL14134767 | 0.74 | — | — | |
| SCHEMBL7565303 | 0.72 | — | — | |
| SCHEMBL9195634 | 0.72 | — | — | |
| SCHEMBL2385629 | 0.72 | — | — | |
| SCHEMBL272858 | 0.71 | TDP1 (0.36) | — | |
| SCHEMBL12475284 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL30142886 | 0.70 | — | — | |
| SCHEMBL20216035 | 0.70 | — | — | |
| SCHEMBL1669658 | 0.70 | — | — |
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-2021121327-A1 | SUBSTITUTED STRAIGHT CHAIN SPIRO DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 2021-06-24 | — | — | WO | disclosed |