⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24200792 | 0.82 | NPC1 (0.33) | — | |
| SCHEMBL20069844 | 0.77 | RET (0.30) | — | |
| SCHEMBL12522204 | 0.76 | GBA1 (0.32) | — | |
| SCHEMBL24688967 | 0.76 | — | — | |
| SCHEMBL25502493 | 0.72 | GBA1 (0.30) | — | |
| SCHEMBL23114601 | 0.71 | ATM (0.41) | — | |
| SCHEMBL12448083 | 0.71 | — | — | |
| SCHEMBL25905787 | 0.71 | CTSV (0.32) | — | |
| SCHEMBL1723710 | 0.69 | PDK2 (0.33) | — | |
| SCHEMBL1723708 | 0.69 | PDK2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11078201-B2 | Substituted isoindolin-1-ones and 2,3-dihydro-1H-pyrrol[3,4-c]pyridin-1-ones as HPK1 antagonists | Nimbus Saturn, Inc. (US) | 2021-08-03 | — | — | US | disclosed |