⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14360218 | 0.72 | KMT2A (0.40) | — | |
| SCHEMBL2738575 | 0.71 | — | — | |
| SCHEMBL24942357 | 0.69 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL15080602 | 0.68 | — | — | |
| SCHEMBL188995 | 0.67 | — | — | |
| SCHEMBL12200371 | 0.67 | — | — | |
| SCHEMBL188431 | 0.67 | — | — | |
| SCHEMBL188282 | 0.67 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL12921166 | 0.67 | — | — | |
| SCHEMBL12200377 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2075244-A1 | New route to building block for making renin inhibitors | DSMIP Assets B.V. (NL) | 2009-07-01 | — | — | EP | disclosed |