⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9181949 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL14305831 | 0.69 | — | — | |
| SCHEMBL1641546 | 0.69 | — | — | |
| SCHEMBL799767 | 0.69 | — | — | |
| SCHEMBL14769850 | 0.67 | — | — | |
| SCHEMBL12804840 | 0.65 | — | — | |
| SCHEMBL8805845 | 0.64 | — | — | |
| SCHEMBL19579509 | 0.64 | — | — | |
| SCHEMBL18177927 | 0.63 | TSHR (0.38) | — | |
| SCHEMBL18177926 | 0.63 | TSHR (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20140017291-A1 | Microbes Encapsulated within Crosslinkable Polymers | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK | 2014-01-16 | — | — | US | disclosed |
| US-8367109-B2 | Microbes encapsulated within crosslinkable polymers | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2013-02-05 | — | — | US | disclosed |
| US-20090258051-A1 | Microbes Encapsulated Within Crosslinkable Polymers | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2009-10-15 | — | — | US | disclosed |