⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1091555 | 0.72 | — | — | |
| SCHEMBL2322363 | 0.67 | — | — | |
| SCHEMBL1768522 | 0.67 | — | — | |
| SCHEMBL3153367 | 0.67 | — | — | |
| SCHEMBL2287009 | 0.67 | — | — | |
| SCHEMBL2329633 | 0.67 | — | — | |
| SCHEMBL10817001 | 0.67 | — | — | |
| SCHEMBL10413298 | 0.67 | — | — | |
| SCHEMBL4061769 | 0.67 | — | — | |
| SCHEMBL12863928 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210009550-A1 | UREA MOTIF CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS ANTIBACTERIAL DRUGS | Technische Universität München (DE) | 2021-01-14 | — | — | US | disclosed |
| EP-0272694-A1 | 2-Dithioalkyl-dihydropyridines, a method for their preparation and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1988-06-29 | — | — | EP | disclosed |