⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15882578 | 0.85 | DGAT1 (0.32) | — | |
| SCHEMBL18403229 | 0.84 | — | — | |
| SCHEMBL722670 | 0.73 | DGAT1 (0.33) | — | |
| SCHEMBL19588445 | 0.72 | — | — | |
| SCHEMBL21912465 | 0.71 | DGAT1 (0.31) | — | |
| SCHEMBL15699637 | 0.70 | CALCRL (0.31) | — | |
| SCHEMBL3516319 | 0.70 | HSD17B10 (0.40) | — | |
| SCHEMBL29599153 | 0.67 | FFAR1 (0.31) | — | |
| SCHEMBL15882795 | 0.67 | FFAR1 (0.31) | — | |
| SCHEMBL19142915 | 0.64 | CSF1R (0.34) | — |
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-3268373-A1 | TRICYCLIC DLK INHIBITORS AND USES THEREOF | F. Hoffmann-La Roche AG (CH) | 2018-01-17 | — | — | EP | disclosed |
| WO-2016142310-A1 | TRICYCLIC DLK INHIBITORS AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2016-09-15 | — | — | WO | disclosed |