⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL736603 | 0.89 | KDM4E (0.30) | — | |
| SCHEMBL1135132 | 0.89 | KDM4E (0.30) | — | |
| Hydrochloric Acid SCHEMBL10636938 | 0.87 | — | — | |
| SCHEMBL1486043 | 0.87 | GABRP (0.30) | — | |
| SCHEMBL1135129 | 0.87 | GABRP (0.30) | — | |
| SCHEMBL23930371 | 0.77 | — | — | |
| SCHEMBL4098173 | 0.76 | — | — | |
| SCHEMBL9465805 | 0.76 | FDPS (0.33) | — | |
| SCHEMBL4830545 | 0.74 | — | — | |
| SCHEMBL33997 | 0.73 | TDP1 (0.31) | — |
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-2153877-A1 | Mixed graft polymers for ion exchange chromatography | MERCK PATENT GmbH (DE) | 2010-02-17 | — | — | EP | claimed |
| EP-2153877-A1 | Mixed graft polymers for ion exchange chromatography | MERCK PATENT GmbH (DE) | 2010-02-17 | — | — | EP | disclosed |