⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18124965 | 0.75 | — | — | |
| SCHEMBL20226979 | 0.68 | — | — | |
| SCHEMBL19217076 | 0.67 | KMT2A (0.32) | — | |
| SCHEMBL15381291 | 0.64 | KMT2A (0.38) | — | |
| SCHEMBL17340952 | 0.62 | — | — | |
| SCHEMBL15962884 | 0.62 | KMT2A (0.32) | — | |
| SCHEMBL22563726 | 0.62 | CARM1 (0.35) | — | |
| SCHEMBL15478457 | 0.61 | SOS1 (0.34) | — | |
| SCHEMBL20657167 | 0.61 | — | — | |
| SCHEMBL15962737 | 0.60 | KMT2A (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007084413-A2 | METHODS FOR TREATING HEPATITIS C | PTC THERAPEUTICS, INC. (US) | 2007-07-26 | — | — | WO | disclosed |