⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4767756 | 1.00 | — | — | |
| SCHEMBL4763779 | 1.00 | — | — | |
| SCHEMBL17803612 | 0.86 | APLNR (0.42) | — | |
| SCHEMBL3963034 | 0.84 | APLNR (0.38) | — | |
| SCHEMBL18709640 | 0.78 | — | — | |
| SCHEMBL28464363 | 0.78 | APLNR (0.34) | — | |
| Oxirane SCHEMBL25299382 | 0.76 | APLNR (0.39) | — | |
| SCHEMBL24248222 | 0.75 | — | — | |
| SCHEMBL459431 | 0.75 | — | — | |
| SCHEMBL8311349 | 0.75 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896422-A2 | TYROSINE KINASE INHIBITORS | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2007002258-A2 | BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |
| CN-111393391-B | Antiviral agent for hepatitis B virus infection | 南京安纳康生物科技有限公司 | 2022-07-26 | — | — | CN | disclosed |
| EP-1896421-A2 | BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007002254-A2 | BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |