⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20862901 | 0.69 | — | — | |
| SCHEMBL28307728 | 0.67 | — | — | |
| SCHEMBL22114464 | 0.63 | GRIN2D (0.31) | — | |
| SCHEMBL17085429 | 0.61 | — | — | |
| SCHEMBL14235091 | 0.59 | — | — | |
| SCHEMBL466043 | 0.56 | — | — | |
| SCHEMBL161626 | 0.55 | — | — | |
| SCHEMBL10227443 | 0.54 | — | — | |
| SCHEMBL8052423 | 0.53 | — | — | |
| SCHEMBL30114995 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3461556-A1 | PHOSPHINE LIGANDS FOR CATALYTIC REACTIONS | AbbVie Ireland Unlimited Company (IE) | 2019-04-03 | — | — | EP | disclosed |
| US-20120014913-A1 | PROCESS FOR PREPARING ANTIVIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-01-19 | — | — | US | disclosed |