⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1884889 | 0.55 | — | — | |
| SCHEMBL9066885 | 0.55 | — | — | |
| SCHEMBL1876497 | 0.52 | — | — | |
| SCHEMBL329462 | 0.50 | — | — | |
| SCHEMBL6718535 | 0.50 | — | — | |
| SCHEMBL6360329 | 0.45 | — | — | |
| SCHEMBL18027480 | 0.45 | — | — | |
| SCHEMBL10338943 | 0.44 | — | — | |
| SCHEMBL2353104 | 0.44 | — | — | |
| SCHEMBL94238 | 0.40 | — | — |
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-20050154277-A1 | Apparatus and methods of using built-in micro-spectroscopy micro-biosensors and specimen collection system for a wireless capsule in a biological body in vivo | TANG JING (US) | 2005-07-14 | — | — | US | disclosed |