⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21094309 | 1.00 | — | — | |
| SCHEMBL21094244 | 1.00 | — | — | |
| SCHEMBL20556605 | 1.00 | — | — | |
| SCHEMBL20557049 | 0.95 | — | — | |
| SCHEMBL20557113 | 0.95 | — | — | |
| SCHEMBL20556927 | 0.90 | — | — | |
| SCHEMBL20557062 | 0.89 | — | — | |
| SCHEMBL20557128 | 0.88 | — | — | |
| SCHEMBL21276150 | 0.88 | USP2 (0.51) | — | |
| SCHEMBL20556956 | 0.88 | — | — |
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-10323038-B2 | Pyrazole compounds and methods of making and using same | ABIDE THERAPEUTICS, INC. (US) | 2019-06-18 | — | — | US | disclosed |