⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13311912 | 0.81 | CA1 (0.33) | — | |
| SCHEMBL172878 | 0.79 | CA1 (0.35) | — | |
| SCHEMBL18407028 | 0.79 | CA1 (0.35) | — | |
| SCHEMBL17533431 | 0.79 | — | — | |
| SCHEMBL17533430 | 0.78 | — | — | |
| SCHEMBL15372975 | 0.76 | — | — | |
| SCHEMBL9452633 | 0.75 | — | — | |
| SCHEMBL28917428 | 0.74 | CA1 (0.38) | — | |
| SCHEMBL17533432 | 0.73 | — | — | |
| SCHEMBL11798747 | 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-2016026937-A1 | NEW SPIRO[3H-INDOLE-3,2´-PYRROLIDIN]-2(1H)-ONE COMPOUNDS AND DERIVATIVES AS MDM2-P53 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2016-02-25 | — | — | WO | disclosed |