⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6926886 | 0.90 | — | — | |
| SCHEMBL6926878 | 0.88 | CA1 (0.36) | — | |
| SCHEMBL7198556 | 0.87 | CA12 (0.33) | — | |
| SCHEMBL6928605 | 0.85 | HPRT1 (0.31) | — | |
| SCHEMBL6926212 | 0.80 | GRIN1 (0.33) | — | |
| SCHEMBL6927156 | 0.80 | DAO (0.33) | — | |
| SCHEMBL6923316 | 0.80 | GRIN1 (0.36) | — | |
| SCHEMBL7199614 | 0.79 | EGLN1 (0.30) | — | |
| SCHEMBL6928590 | 0.78 | DAO (0.46) | — | |
| SCHEMBL6929437 | 0.78 | POLB (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6596709-B1 | For treatment of Alzheimer's disease, schizophrenia, amyotrophic lateral sclerosis, and Huntington's chorea | LES LABORATOIRES SERVIER (FR) | 2003-07-22 | — | — | US | disclosed |
| US-6518258-B1 | 6-sulphamoyl -3-quinolyphosphonic acid compounds | LES LABORATOIRES SERVIER (FR) | 2003-02-11 | — | — | US | disclosed |