⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18081572 | 0.71 | — | — | |
| SCHEMBL1666018 | 0.69 | — | — | |
| SCHEMBL2146054 | 0.63 | — | — | |
| SCHEMBL28203879 | 0.62 | — | — | |
| SCHEMBL27388395 | 0.60 | — | — | |
| SCHEMBL10805695 | 0.59 | — | — | |
| SCHEMBL27531436 | 0.59 | — | — | |
| SCHEMBL27659266 | 0.59 | — | — | |
| SCHEMBL1445023 | 0.58 | — | — | |
| SCHEMBL4240975 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9115386-B2 | Selective oxidation of 5-methylcytosine by TET-family proteins | CHILDREN'S MEDICAL CENTER CORPORATION (US) | 2015-08-25 | — | — | US | disclosed |