⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19239038 | 0.81 | DGAT1 (0.32) | — | |
| SCHEMBL19239024 | 0.80 | — | — | |
| SCHEMBL19367019 | 0.80 | — | — | |
| SCHEMBL18028242 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL2386487 | 0.79 | SERPINE1 (0.35) | — | |
| SCHEMBL18028229 | 0.78 | — | — | |
| SCHEMBL2022933 | 0.78 | CYP2D6 (0.35) | — | |
| SCHEMBL22200833 | 0.77 | SERPINE1 (0.34) | — | |
| SCHEMBL22200846 | 0.77 | SERPINE1 (0.34) | — | |
| SCHEMBL22200732 | 0.77 | SERPINE1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10259907-B2 | Block copolymers with surface-active junction groups, compositions and processes thereof | AZ ELECTRONIC MATERIALS (LUXEMBOURG) S.À R.L. (LU) | 2019-04-16 | — | — | US | disclosed |