⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5842293 | 0.61 | — | — | |
| SCHEMBL31360983 | 0.60 | — | — | |
| SCHEMBL472598 | 0.55 | — | — | |
| SCHEMBL2909379 | 0.54 | — | — | |
| SCHEMBL20806745 | 0.54 | — | — | |
| SCHEMBL10884014 | 0.54 | TLR4 (0.36) | — | |
| SCHEMBL10767319 | 0.54 | — | — | |
| SCHEMBL2455005 | 0.54 | — | — | |
| SCHEMBL9871570 | 0.54 | — | — | |
| SCHEMBL1894595 | 0.52 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4127568-A | Process for 3β-aminoazetidin-2-ones | ELI LILLY AND COMPANY (US) | 1978-11-28 | — | — | US | claimed |
| US-4243587-A | CYCLIZING A 3-ACYLAMINO-4A-ACETOXYAZETIDINONE ESTER WITH HYDROCHLORIC ACID TO OBTAIN THE 4-OXA-2,6-DIAZABICYCLO(3.2.0)HEPTANE | ELI LILLY AND COMPANY (US) | 1981-01-06 | — | — | US | disclosed |
| US-4226767-A | NOCARDICIN | ELI LILLY AND COMPANY (US) | 1980-10-07 | — | — | US | disclosed |
| US-4180507-A | NOCARDICIN INTERMEDIATE | ELI LILLY AND COMPANY (US) | 1979-12-25 | — | — | US | disclosed |
| US-4127568-A | Process for 3β-aminoazetidin-2-ones | ELI LILLY AND COMPANY (US) | 1978-11-28 | — | — | US | disclosed |