⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31315772 | 0.86 | — | — | |
| Bromide SCHEMBL4471870 | 0.85 | — | — | |
| SCHEMBL28387767 | 0.85 | — | — | |
| SCHEMBL28950338 | 0.83 | — | — | |
| Bromide SCHEMBL22689612 | 0.83 | — | — | |
| SCHEMBL5435337 | 0.80 | — | — | |
| SCHEMBL1985304 | 0.78 | — | — | |
| Bromide SCHEMBL31536069 | 0.78 | — | — | |
| SCHEMBL1996789 | 0.76 | — | — | |
| SCHEMBL7219785 | 0.76 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101426786-A | Benzazole potentiators of metabotropic glutamate receptors | MERCK & CO INC (US) | 2009-05-06 | — | — | CN | disclosed |
| WO-2006098624-A2 | ANTI-VIRAL USE OF A COUMARIN AGENT | RADEMAKER HOLDING B.V. (NL) | 2006-09-21 | — | — | WO | disclosed |
| WO-2006098620-A1 | USE OF DERIVATIVES COMPRISING A COUMARIN GROUP FOR THE PREPARATION OF AN ANTIVIRAL AGENT, DERIVATIVES COMPRISING A COUMARIN GROUP, A METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | RADEMAKER HOLDING B.V. (NL) | 2006-09-21 | — | — | WO | disclosed |