⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17420002 | 1.00 | — | — | |
| SCHEMBL22689404 | 0.96 | — | — | |
| SCHEMBL17419998 | 0.96 | — | — | |
| SCHEMBL3787785 | 0.92 | — | — | |
| SCHEMBL16178525 | 0.83 | PTGS1 (0.32) | — | |
| SCHEMBL476070 | 0.83 | PTGS1 (0.32) | — | |
| SCHEMBL4917524 | 0.78 | — | — | |
| SCHEMBL4919958 | 0.78 | — | — | |
| SCHEMBL4919114 | 0.77 | — | — | |
| SCHEMBL3782512 | 0.72 | FFAR3 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020235516-A1 | MULTILAYER ANTIFOULING COATING AND COATED OBJECT HAVING SAID COATING ON SURFACE | 日東化成株式会社 (JP) | 2020-11-26 | — | — | WO | disclosed |