⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL629378 | 1.00 | — | — | |
| SCHEMBL28681679 | 0.92 | — | — | |
| SCHEMBL28681693 | 0.75 | — | — | |
| SCHEMBL28485691 | 0.71 | — | — | |
| SCHEMBL27617110 | 0.66 | ADORA3 (0.30) | — | |
| SCHEMBL29440550 | 0.62 | — | — | |
| SCHEMBL8396507 | 0.62 | — | — | |
| SCHEMBL7855060 | 0.60 | — | — | |
| SCHEMBL8993425 | 0.59 | — | — | |
| SCHEMBL5058259 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2041159-A1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2009-04-01 | — | — | EP | claimed |
| WO-2007148135-A1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-12-27 | — | — | WO | claimed |
| EP-2041159-B8 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | ANGELETTI P IST RICHERCHE BIO (IT) | 2012-02-22 | — | — | EP | disclosed |
| EP-2041159-A1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2009-04-01 | — | — | EP | disclosed |
| WO-2007148135-A1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-12-27 | — | — | WO | disclosed |