⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11224225 | 0.79 | — | — | |
| SCHEMBL23260535 | 0.77 | SSTR4 (0.40) | — | |
| SCHEMBL1104703 | 0.76 | — | — | |
| SCHEMBL24402034 | 0.75 | SSTR4 (0.43) | — | |
| SCHEMBL6130349 | 0.73 | TSHR (0.37) | — | |
| SCHEMBL61662 | 0.73 | TSHR (0.37) | — | |
| SCHEMBL6130372 | 0.73 | TSHR (0.37) | — | |
| SCHEMBL1104693 | 0.72 | — | — | |
| SCHEMBL841864 | 0.72 | — | — | |
| SCHEMBL1104696 | 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-9920060-B2 | Pyrazolo[3,4-d]pyrimidine compound or salt thereof | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2018-03-20 | — | — | US | disclosed |
| US-20170217970-A1 | NOVEL PYRAZOLO[3,4-d]PYRIMIDINE COMPOUND OR SALT THEREOF | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2017-08-03 | — | — | US | disclosed |