⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19755633 | 0.83 | HRH3 (0.32) | — | |
| SCHEMBL21075797 | 0.83 | HRH3 (0.32) | — | |
| SCHEMBL19755636 | 0.77 | HRH3 (0.32) | — | |
| SCHEMBL17827391 | 0.77 | HRH3 (0.31) | — | |
| SCHEMBL19755634 | 0.74 | HRH3 (0.32) | — | |
| SCHEMBL19755637 | 0.74 | HRH3 (0.34) | — | |
| SCHEMBL19353348 | 0.72 | — | — | |
| SCHEMBL24817964 | 0.72 | HRH3 (0.33) | — | |
| SCHEMBL14524119 | 0.72 | HRH3 (0.33) | — | |
| SCHEMBL24840554 | 0.72 | — | — |
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-11186578-B2 | Substituted pyrrolo[3,2-d]pyrimidines and pyrazolo[4,3-d]pyrimidines as tyrosine kinase inhibitors | SHENZHEN TARGETRX, INC. (CN) | 2021-11-30 | — | — | US | disclosed |
| US-20210070758-A1 | FUSED BICYCLIC COMPOUND FOR INHIBITING ACTIVITY OF TYROSINE KINASE | Shenzhen TargetRx. Inc. (CN) | 2021-03-11 | — | — | US | disclosed |