⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL913035 | 1.00 | — | — | |
| SCHEMBL912845 | 0.90 | HTR2A (0.30) | — | |
| SCHEMBL3304989 | 0.90 | HTR2A (0.30) | — | |
| SCHEMBL913198 | 0.90 | HTR2A (0.30) | — | |
| SCHEMBL12710235 | 0.89 | HTR2A (0.32) | — | |
| SCHEMBL912517 | 0.87 | HTR2A (0.37) | — | |
| SCHEMBL912518 | 0.87 | HTR2A (0.37) | — | |
| SCHEMBL3308813 | 0.82 | HTR2A (0.40) | — | |
| SCHEMBL3308733 | 0.82 | HTR2A (0.40) | — | |
| SCHEMBL3301217 | 0.81 | SMN1; SMN2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110003689-A1 | USE OF POLYMERIC GUANIDINE DERIVATIVES FOR THE CONTROL OF UNWANTED MICROORGANISMS IN CROP PROTECTION | AKA TECHNOLOGY GMBH (AT) | 2011-01-06 | — | — | US | claimed |
| EP-2014167-A1 | Active compound combinations | Bayer CropScience AG (DE) | 2009-01-14 | — | — | EP | claimed |
| US-20110003689-A1 | USE OF POLYMERIC GUANIDINE DERIVATIVES FOR THE CONTROL OF UNWANTED MICROORGANISMS IN CROP PROTECTION | AKA TECHNOLOGY GMBH (AT) | 2011-01-06 | — | — | US | disclosed |
| EP-2071954-A1 | Use of polymeric guanidine derivatives for combating unwanted micro-organisms in the protection of plants | Bayer CropScience AG (DE) | 2009-06-24 | — | — | EP | disclosed |
| EP-2014167-A1 | Active compound combinations | Bayer CropScience AG (DE) | 2009-01-14 | — | — | EP | disclosed |