⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17920060 | 1.00 | — | — | |
| SCHEMBL3316630 | 1.00 | — | — | |
| SCHEMBL14642985 | 0.95 | ALDH1A1 (0.36) | — | |
| SCHEMBL15218457 | 0.88 | ALDH1A1 (0.43) | — | |
| SCHEMBL7518724 | 0.88 | HSD17B10 (0.36) | — | |
| SCHEMBL20064605 | 0.83 | HSD17B10 (0.44) | — | |
| SCHEMBL6173845 | 0.83 | HSD17B10 (0.33) | — | |
| SCHEMBL20850620 | 0.81 | HSD17B10 (0.42) | — | |
| SCHEMBL21598304 | 0.81 | ALDH1A1 (0.38) | — | |
| SCHEMBL21598310 | 0.81 | ALDH1A1 (0.38) | — |
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-20170291825-A1 | PRODUCTION OF AMMONIUM SULFATE USING A VACUUM ABSORPTION PROCESS | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK | 2017-10-12 | — | — | US | disclosed |