⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26657200 | 0.75 | — | — | |
| SCHEMBL26999260 | 0.73 | — | — | |
| SCHEMBL8531863 | 0.72 | — | — | |
| SCHEMBL4478768 | 0.72 | — | — | |
| SCHEMBL2272358 | 0.72 | — | — | |
| SCHEMBL7039540 | 0.68 | — | — | |
| SCHEMBL2616439 | 0.68 | — | — | |
| SCHEMBL4561668 | 0.68 | — | — | |
| SCHEMBL9963209 | 0.66 | — | — | |
| SCHEMBL9332110 | 0.66 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114007610-A | Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2022-02-01 | — | — | CN | claimed |
| CN-104918939-A | Purine inhibitors of human phosphatidylinositol 3-kinase | MERCK SHARP & DOHME | 2015-09-16 | — | — | CN | claimed |
| CN-117088884-A | Imidazopyridazine derivatives as GABAA receptor modulators, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-114007610-A | Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2022-02-01 | — | — | CN | disclosed |
| US-20190047960-A1 | PYRIDIN-2-ONE DERIVATIVES OF FORMULA (II) USEFUL AS EP3 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2019-02-14 | — | — | US | disclosed |
| CN-104918939-A | Purine inhibitors of human phosphatidylinositol 3-kinase | MERCK SHARP & DOHME | 2015-09-16 | — | — | CN | disclosed |
| CN-104892525-A | Arylcyclopropylamine based demethylase inhibitors of LSD1 and their medical use | ORYZON GENOMICS SA | 2015-09-09 | — | — | CN | disclosed |
| CN-103124724-B | Arylcyclopropylamine-based demethylase inhibitors of LSD1 and their medical use | ORYZON GENOMICS SA | 2015-05-20 | — | — | CN | disclosed |
| CN-103124724-A | Arylcyclopropylamine-based demethylase inhibitors of LSD1 and their medical use | ORYZON GENOMICS SA | 2013-05-29 | — | — | CN | disclosed |