⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12451668 | 0.91 | — | — | |
| SCHEMBL12451674 | 0.83 | — | — | |
| SCHEMBL12451666 | 0.82 | — | — | |
| SCHEMBL9797843 | 0.79 | EPHX1 (0.33) | — | |
| SCHEMBL10093779 | 0.77 | — | — | |
| SCHEMBL17123471 | 0.75 | — | — | |
| SCHEMBL18978918 | 0.75 | — | — | |
| SCHEMBL12451665 | 0.74 | — | — | |
| SCHEMBL860349 | 0.71 | — | — | |
| SCHEMBL373996 | 0.70 | ADRB2 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120238661-A1 | Processes for the Synthesis of Compounds from Cyclic Carbonates | COGNIS IP MANAGEMENT GMBH (DE) | 2012-09-20 | — | — | US | disclosed |