⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8623683 | 1.00 | — | — | |
| SCHEMBL11364010 | 0.79 | — | — | |
| SCHEMBL1267433 | 0.76 | — | — | |
| SCHEMBL1267432 | 0.76 | — | — | |
| SCHEMBL10405949 | 0.74 | TSHR (0.30) | — | |
| SCHEMBL29446746 | 0.74 | TSHR (0.31) | — | |
| SCHEMBL14898 | 0.74 | — | — | |
| SCHEMBL26739247 | 0.74 | — | — | |
| SCHEMBL14897 | 0.74 | — | — | |
| SCHEMBL27970435 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5760192-A | FREE RADICAL, POLYMERIZATION CATALYSTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1998-06-02 | — | — | US | claimed |