⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28994146 | 0.82 | — | — | |
| SCHEMBL3306197 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL11845673 | 0.74 | — | — | |
| SCHEMBL4718668 | 0.74 | NOTUM (0.33) | — | |
| SCHEMBL28092491 | 0.73 | CYP11B2 (0.32) | — | |
| SCHEMBL6408788 | 0.73 | — | — | |
| SCHEMBL28166840 | 0.71 | PDE4B (0.32) | — | |
| SCHEMBL11531912 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL2081255 | 0.70 | NPC1 (0.43) | — | |
| SCHEMBL1240961 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116981458-A | Compounds with tetrahydroindole-1-carboxamides as BCL-2 inhibitors | 伊尔治疗学股份有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-116981458-A | Compounds with tetrahydroindole-1-carboxamides as BCL-2 inhibitors | 伊尔治疗学股份有限公司 | 2023-10-31 | — | — | CN | disclosed |