⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2381676 | 0.68 | — | — | |
| SCHEMBL4432319 | 0.59 | — | — | |
| SCHEMBL4242547 | 0.57 | DYRK1A (0.41) | — | |
| SCHEMBL2549990 | 0.55 | — | — | |
| SCHEMBL4240710 | 0.54 | HTR6 (0.38) | — | |
| SCHEMBL16181675 | 0.52 | — | — | |
| SCHEMBL21321548 | 0.52 | — | — | |
| SCHEMBL24142864 | 0.50 | — | — | |
| SCHEMBL22681182 | 0.50 | — | — | |
| SCHEMBL8005685 | 0.49 | — | — |
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-1087953-A1 | NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES | NICOX S.A. (FR) | 2001-04-04 | — | — | EP | claimed |
| WO-1999067231-A1 | NITRATE SALTS OF ANTIHYPERTENSIVE MEDICINES | NICOX S.A. (FR) | 1999-12-29 | — | — | WO | claimed |