⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22270766 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL19424165 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL11957184 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL22540549 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL20031391 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL24196772 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL12873545 | 0.71 | — | — | |
| SCHEMBL20031296 | 0.70 | CHRNB2 (0.32) | — | |
| SCHEMBL25071667 | 0.70 | CHRNB2 (0.32) | — | |
| SCHEMBL22704391 | 0.70 | CHRNB2 (0.32) | — |
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-10633366-B2 | Antibacterial compounds | AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) | 2020-04-28 | — | — | US | disclosed |
| US-20190161472-A1 | NEW ANTIBACTERIAL COMPOUNDS | AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) | 2019-05-30 | — | — | US | disclosed |