⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28304 | 1.00 | — | — | |
| SCHEMBL1331469 | 0.87 | — | — | |
| SCHEMBL11874649 | 0.87 | — | — | |
| SCHEMBL28598879 | 0.87 | — | — | |
| SCHEMBL23524759 | 0.87 | — | — | |
| SCHEMBL25254267 | 0.87 | — | — | |
| Water SCHEMBL2943146 | 0.87 | — | — | |
| SCHEMBL5142229 | 0.87 | — | — | |
| SCHEMBL19991822 | 0.87 | — | — | |
| SCHEMBL1411719 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2421376-A1 | NON-INVASIVE ENERGY UPCONVERSION METHODS AND SYSTEMS FOR IN-SITU PHOTOBIOMODULATION | Immunolight, Llc. (US) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010123993-A1 | NON-INVASIVE ENERGY UPCONVERSION METHODS AND SYSTEMS FOR IN-SITU PHOTOBIOMODULATION | VO-DINH TUAN (US) | 2010-10-28 | — | — | WO | disclosed |