⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25896132 | 0.90 | HTR6 (0.31) | — | |
| SCHEMBL25877380 | 0.90 | — | — | |
| SCHEMBL25896128 | 0.87 | — | — | |
| SCHEMBL25896126 | 0.84 | L3MBTL1 (0.41) | — | |
| SCHEMBL25934604 | 0.83 | PLA2G2A (0.31) | — | |
| SCHEMBL25877384 | 0.80 | — | — | |
| SCHEMBL26020398 | 0.79 | — | — | |
| SCHEMBL25934635 | 0.79 | — | — | |
| SCHEMBL25877357 | 0.79 | NR3C1 (0.31) | — | |
| SCHEMBL24123729 | 0.76 | F2RL3 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230234969-A1 | N-LINKED MACROCYCLIC 7-(PYRAZOL-5-YL)-INDOLE DERIVATIVES AS INHIBIORS OF MCL-1 | JANSSEN PHARMACEUTICA NV (BE) | 2023-07-27 | — | — | US | disclosed |
| US-20230234969-A1 | N-LINKED MACROCYCLIC 7-(PYRAZOL-5-YL)-INDOLE DERIVATIVES AS INHIBIORS OF MCL-1 | JANSSEN PHARMACEUTICA NV (BE) | 2023-07-27 | — | — | US | disclosed |