⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7936015 | 0.77 | — | — | |
| SCHEMBL5137603 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL5674924 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL5674928 | 0.73 | — | — | |
| SCHEMBL16656061 | 0.62 | — | — | |
| SCHEMBL468475 | 0.61 | — | — | |
| Fluoride SCHEMBL1130376 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL5013199 | 0.60 | — | — | |
| SCHEMBL6705766 | 0.60 | HTR6 (0.49) | — | |
| SCHEMBL20015398 | 0.59 | GABRA1 (0.32) | — |
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-20080039606-A9 | Polyethylene resins | BARRY DAVID B | 2008-02-14 | — | — | US | claimed |
| US-20070173623-A1 | Polyethylene resins | UNIVATION TECHNOLOGIES, LLC | 2007-07-26 | — | — | US | claimed |