⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7010827 | 0.81 | CA1 (0.31) | — | |
| SCHEMBL14685471 | 0.75 | — | — | |
| SCHEMBL17595079 | 0.74 | — | — | |
| SCHEMBL11651861 | 0.74 | — | — | |
| SCHEMBL3618771 | 0.71 | — | — | |
| SCHEMBL775953 | 0.70 | — | — | |
| SCHEMBL8438478 | 0.70 | — | — | |
| SCHEMBL14777112 | 0.70 | — | — | |
| SCHEMBL27653258 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL1886966 | 0.69 | — | — |
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-20120135537-A1 | DETECTION OF A COMPONENT OF INTEREST WITH AN ULTRAVIOLET LASER AND METHOD OF USING THE SAME | ARKANSAS STATE UNIVERSITY RESEARCH AND DEVELOPMENT INSTITUTE (US) | 2012-05-31 | — | — | US | disclosed |
| US-8174691-B1 | Detection of a component of interest with an ultraviolet laser and method of using the same | Arkansas State University—Jonesboro (US) | 2012-05-08 | — | — | US | disclosed |