⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19563 | 0.78 | — | — | |
| SCHEMBL28612838 | 0.73 | — | — | |
| SCHEMBL5943329 | 0.72 | — | — | |
| SCHEMBL14721672 | 0.70 | — | — | |
| SCHEMBL609970 | 0.67 | — | — | |
| Ethylene SCHEMBL22654082 | 0.67 | — | — | |
| SCHEMBL934285 | 0.67 | — | — | |
| SCHEMBL177915 | 0.67 | — | — | |
| SCHEMBL11395942 | 0.67 | — | — | |
| SCHEMBL9376 | 0.65 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210388223-A1 | MICROPARTICLE COMPOSITION COMPRISING AN ORGANIC IR ABSORBING PIGMENT | BASF SE (DE) | 2021-12-16 | — | — | US | disclosed |
| WO-2020079154-A1 | MICROPARTICLE COMPOSITION COMPRISING AN ORGANIC IR ABSORBING PIGMENT | BASF SE (DE) | 2020-04-23 | — | — | WO | disclosed |
| WO-1997032858-A1 | QUINOXALINE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-09-12 | — | — | WO | disclosed |