⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL7887994 | 0.97 | — | — | |
| SCHEMBL4576688 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL4327932 | 0.97 | — | — | |
| SCHEMBL4327918 | 0.83 | — | — | |
| SCHEMBL4576208 | 0.77 | — | — | |
| SCHEMBL8148453 | 0.67 | — | — | |
| SCHEMBL7471349 | 0.65 | — | — | |
| Lithium SCHEMBL9143824 | 0.63 | — | — | |
| SCHEMBL7871595 | 0.63 | — | — | |
| SCHEMBL10594650 | 0.63 | — | — |
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-20050267273-A1 | Ethylene polymer, preparation process thereof and molded articles of the same | MITSUI CHEMICALS, INC. | 2005-12-01 | — | — | US | disclosed |
| US-20020107343-A1 | Ethylene polymer, preparation process thereof and molded articles of the same | MITSUI CHEMICALS, INC. | 2002-08-08 | — | — | US | disclosed |