⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11250303 | 1.00 | — | — | |
| SCHEMBL3632234 | 0.76 | — | — | |
| SCHEMBL3101667 | 0.76 | — | — | |
| SCHEMBL59994 | 0.76 | — | — | |
| SCHEMBL852746 | 0.76 | — | — | |
| SCHEMBL242590 | 0.76 | — | — | |
| SCHEMBL421917 | 0.76 | — | — | |
| SCHEMBL21933152 | 0.72 | — | — | |
| SCHEMBL1293140 | 0.72 | TSHR (0.37) | — | |
| SCHEMBL4623652 | 0.72 | TSHR (0.37) | — |
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-4351924-A | USING A REACTION PRODUCT OF AN ORGANO ALKALI METAL ACETAL OR KETAL AND 1,1-DIPHENYLETHYLENE; AUTOMOBILE POWDER COATINGS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-09-28 | — | — | US | disclosed |