⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12048974 | 0.69 | — | — | |
| SCHEMBL18175698 | 0.67 | — | — | |
| SCHEMBL16998464 | 0.65 | — | — | |
| SCHEMBL11663368 | 0.65 | — | — | |
| SCHEMBL11663376 | 0.65 | — | — | |
| SCHEMBL23995245 | 0.63 | — | — | |
| SCHEMBL12058904 | 0.63 | — | — | |
| SCHEMBL21610755 | 0.63 | — | — | |
| SCHEMBL21587702 | 0.63 | — | — | |
| SCHEMBL18455072 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014139144-A1 | THERAPEUTIC COMPOUNDS AND COMPOSITIONS | AGIOS PHARMACEUTICALS, INC. (US) | 2014-09-18 | — | — | WO | disclosed |
| EP-2444397-A1 | Heteroaryl-ureas and their use as glucokinase activators | Novo Nordisk A/S (DK) | 2012-04-25 | — | — | EP | disclosed |