⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14538383 | 0.69 | — | — | |
| SCHEMBL22664129 | 0.67 | — | — | |
| SCHEMBL26324377 | 0.62 | KDM4E (0.30) | — | |
| Hydrochloric Acid SCHEMBL32669333 | 0.61 | — | — | |
| Iodide SCHEMBL16504593 | 0.61 | — | — | |
| SCHEMBL7630125 | 0.61 | — | — | |
| SCHEMBL2307623 | 0.60 | — | — | |
| SCHEMBL20286449 | 0.59 | — | — | |
| SCHEMBL5610719 | 0.58 | — | — | |
| SCHEMBL15134784 | 0.58 | PNMT (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20130123225-A1 | INHIBITION OF BACTERIAL BIOFILMS WITH ARYL CARBAMATES | NORTH CAROLINA STATE UNIVERSITY | 2013-05-16 | — | — | US | disclosed |
| WO-2007053725-A2 | NOVEL 1,4-BENZODIAZEPINE-2,5-DIONES WITH THERAPEUTIC PROPERTIES | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2007-05-10 | — | — | WO | disclosed |