⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL838391 | 0.77 | — | — | |
| SCHEMBL6579779 | 0.75 | — | — | |
| SCHEMBL23709967 | 0.75 | — | — | |
| SCHEMBL10389221 | 0.70 | — | — | |
| SCHEMBL29374 | 0.69 | — | — | |
| SCHEMBL1335833 | 0.69 | TSHR (0.56) | — | |
| SCHEMBL4124056 | 0.69 | — | — | |
| SCHEMBL21409742 | 0.67 | — | — | |
| Methane SCHEMBL29017317 | 0.67 | — | — | |
| SCHEMBL29186436 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008090570-A1 | NOVEL ANTIMICROBIALS | PANACEA BIOTEC LTD (IN) | 2008-07-31 | — | — | WO | disclosed |