⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6288914 | 0.87 | — | — | |
| SCHEMBL29156433 | 0.87 | — | — | |
| SCHEMBL10535773 | 0.82 | — | — | |
| SCHEMBL11521893 | 0.82 | — | — | |
| SCHEMBL419396 | 0.82 | — | — | |
| SCHEMBL25598 | 0.82 | — | — | |
| SCHEMBL19137409 | 0.82 | — | — | |
| SCHEMBL4359963 | 0.82 | — | — | |
| SCHEMBL5723927 | 0.82 | — | — | |
| SCHEMBL7626201 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101738374-B | Spin-polarized charge carrier device | HITACHI LTD. (JP) | 2012-02-08 | — | — | CN | disclosed |
| CN-101738374-A | Spin-polarized charge carrier device | HITACHI LTD | 2010-06-16 | — | — | CN | disclosed |
| CN-1680063-A | Two tier brazing process for joining copper tubes to manifolds | UNITED TECHNOLOGIES CORP (US) | 2005-10-12 | — | — | CN | disclosed |