⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21787421 | 0.91 | — | — | |
| SCHEMBL20247336 | 0.86 | — | — | |
| SCHEMBL19558464 | 0.86 | — | — | |
| SCHEMBL29376984 | 0.83 | — | — | |
| SCHEMBL46208 | 0.82 | HTR2A (0.33) | — | |
| SCHEMBL30102569 | 0.81 | — | — | |
| SCHEMBL46099 | 0.81 | — | — | |
| SCHEMBL46202 | 0.81 | MEN1 (0.32) | — | |
| SCHEMBL20247385 | 0.79 | — | — | |
| SCHEMBL22530799 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3701796-A1 | ACTIVE COMPOUND COMBINATIONS | Bayer AG (DE) | 2020-09-02 | — | — | EP | disclosed |
| WO-2020043650-A1 | ACTIVE COMPOUND COMBINATIONS HAVING INSECTICIDAL/ACARICIDAL PROPERTIES | BAYER AKTIENGESELLSCHAFT (DE) | 2020-03-05 | — | — | WO | disclosed |