⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19573951 | 1.00 | — | — | |
| SCHEMBL28410484 | 0.76 | — | — | |
| SCHEMBL13635289 | 0.73 | — | — | |
| SCHEMBL669306 | 0.72 | — | — | |
| SCHEMBL6831273 | 0.71 | NOS3 (0.38) | — | |
| Hydrochloric Acid SCHEMBL167943 | 0.69 | — | — | |
| SCHEMBL15274517 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL21409696 | 0.69 | — | — | |
| Water SCHEMBL20837969 | 0.69 | — | — | |
| SCHEMBL9515831 | 0.69 | NOS3 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021133080-A1 | YTTRIUM/LANTHANIDE METAL PRECURSOR COMPOUND, COMPOSITION COMPRISING SAME FOR FORMING FILM, AND METHOD FOR FORMING YTTRIUM/LANTHANIDE METAL-CONTAINING FILM USING COMPOSITION | 주식회사 유피케미칼 | 2021-07-01 | — | — | WO | disclosed |