⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24232065 | 1.00 | — | — | |
| SCHEMBL24231887 | 1.00 | — | — | |
| SCHEMBL20614174 | 0.91 | — | — | |
| SCHEMBL20597166 | 0.90 | RORC (0.30) | — | |
| SCHEMBL24232238 | 0.89 | TLR4 (0.31) | — | |
| SCHEMBL29370939 | 0.89 | TLR4 (0.31) | — | |
| SCHEMBL20797108 | 0.88 | TLR4 (0.33) | — | |
| SCHEMBL20808303 | 0.88 | TLR4 (0.33) | — | |
| SCHEMBL24231883 | 0.88 | — | — | |
| SCHEMBL20614210 | 0.86 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4189036-A1 | DIBENZOFURAN AND DIBENZOTHIOPHENE DERIVATIVES | Merck Patent GmbH (DE) | 2023-06-07 | — | — | EP | disclosed |
| CN-116057153-A | Dibenzofuran and dibenzothiophene derivatives | 默克专利股份有限公司 | 2023-05-02 | — | — | CN | disclosed |
| WO-2022023399-A1 | DIBENZOFURAN AND DIBENZOTHIOPHENE DERIVATIVES | MERCK PATENT GMBH (DE) | 2022-02-03 | — | — | WO | disclosed |