⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16844621 | 0.67 | NOTUM (0.33) | — | |
| SCHEMBL16844618 | 0.67 | NOTUM (0.33) | — | |
| SCHEMBL16844617 | 0.67 | NOTUM (0.33) | — | |
| SCHEMBL20388811 | 0.67 | — | — | |
| SCHEMBL18943749 | 0.66 | NOTUM (0.32) | — | |
| SCHEMBL22025629 | 0.66 | NOTUM (0.32) | — | |
| SCHEMBL18943063 | 0.66 | CHRM2 (0.33) | — | |
| SCHEMBL22175058 | 0.66 | CHRM2 (0.33) | — | |
| SCHEMBL18943251 | 0.64 | PER2 (0.32) | — | |
| SCHEMBL20388901 | 0.57 | RIPK1 (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-2970234-B1 | METHODS OF SYNTHESIZING A DIFLUOROLACTAM ANALOG | CAYMAN CHEMICAL CO INC (US) | 2018-07-18 | — | — | EP | disclosed |
| EP-3175852-A1 | DIFLUOROLACTAM COMPOSITIONS FOR EP4-MEDIATED OSTEO RELATED DISEASES AND CONDITIONS | Cayman Chemical Company, Incorporated (US) | 2017-06-07 | — | — | EP | disclosed |