⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7891 | 0.71 | — | — | |
| SCHEMBL298780 | 0.71 | — | — | |
| SCHEMBL9001123 | 0.68 | — | — | |
| Water SCHEMBL11864826 | 0.68 | — | — | |
| Charcoal, Activated SCHEMBL31348358 | 0.68 | — | — | |
| SCHEMBL10604312 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL341034 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL308873 | 0.68 | — | — | |
| SCHEMBL4485842 | 0.68 | — | — | |
| Methylene Chloride SCHEMBL28991838 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5225489-A | Molding materials | ALLIED-SIGNAL INC. (US) | 1993-07-06 | — | — | US | disclosed |
| US-4980232-A | RANDOM ORIENTED MIXTURE OF VARYING LENGTH AND DIAMETER | ALLIED-SIGNAL INC. (US) | 1990-12-25 | — | — | US | disclosed |