⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7525549 | 0.69 | GNAI3 (0.33) | — | |
| SCHEMBL22045062 | 0.66 | SIGMAR1 (0.33) | — | |
| SCHEMBL1128451 | 0.66 | SIGMAR1 (0.37) | — | |
| SCHEMBL29942935 | 0.64 | — | — | |
| SCHEMBL7231185 | 0.64 | — | — | |
| SCHEMBL9988992 | 0.62 | — | — | |
| SCHEMBL4745377 | 0.62 | CA2 (0.38) | — | |
| Acetic Acid SCHEMBL3415860 | 0.61 | KMT2A (0.36) | — | |
| SCHEMBL7225156 | 0.61 | SIGMAR1 (0.30) | — | |
| SCHEMBL7225162 | 0.61 | SIGMAR1 (0.30) | — |
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-2074093-A2 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2009-07-01 | — | — | EP | claimed |
| WO-2008023336-A2 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2008-02-28 | — | — | WO | claimed |