⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9936794 | 0.69 | — | — | |
| SCHEMBL3728212 | 0.68 | TSHR (0.37) | — | |
| SCHEMBL9168548 | 0.68 | NOS1 (0.50) | — | |
| Silver SCHEMBL9168531 | 0.68 | NOS1 (0.50) | — | |
| SCHEMBL32679425 | 0.68 | TSHR (0.37) | — | |
| SCHEMBL2931909 | 0.67 | — | — | |
| SCHEMBL6052169 | 0.67 | GPR35 (0.44) | — | |
| SCHEMBL11756919 | 0.67 | MEN1 (0.47) | — | |
| SCHEMBL3214378 | 0.67 | HSD17B10 (0.38) | — | |
| SCHEMBL1023472 | 0.67 | ALDH1A1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8361627-B2 | Anti-corrosion layer for aluminum and magnesium alloys | EADS DEUTSCHLAND GMBH (DE) | 2013-01-29 | — | — | US | disclosed |
| US-20120021232-A1 | ANTI-CORROSION LAYER FOR ALUMINUM AND MAGNESIUM ALLOYS | TECHNISCHE UNIVERSITÄT WIEN (AT) | 2012-01-26 | — | — | US | disclosed |