⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4847573 | 0.78 | — | — | |
| SCHEMBL3040316 | 0.75 | — | — | |
| SCHEMBL645404 | 0.75 | — | — | |
| SCHEMBL383720 | 0.73 | — | — | |
| SCHEMBL1679352 | 0.69 | — | — | |
| SCHEMBL7119890 | 0.67 | — | — | |
| SCHEMBL8695678 | 0.67 | EPHX1 (0.54) | — | |
| SCHEMBL639900 | 0.67 | — | — | |
| SCHEMBL23209440 | 0.65 | — | — | |
| SCHEMBL16892517 | 0.65 | EPHX1 (0.58) | — |
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-20100215604-A1 | Cosmetic Compositions with Chitosan and Silicone Elastomers | HENKEL AG & CO. KGAA (DE) | 2010-08-26 | — | — | US | disclosed |