⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22572767 | 0.99 | — | — | |
| SCHEMBL2805849 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL22572757 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL22607466 | 0.86 | — | — | |
| SCHEMBL7942063 | 0.86 | — | — | |
| SCHEMBL2803238 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL18632125 | 0.85 | — | — | |
| Hydrochloric Acid SCHEMBL22607464 | 0.84 | — | — | |
| SCHEMBL6003869 | 0.84 | — | — | |
| SCHEMBL15184712 | 0.81 | — | — |
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-6316558-B1 | POLYMERIZING OLEFIN USING CATALYST COMPRISING TRANSITION METAL COMPOUND, COMPOUND CAPABLE OF A REACTING WITH TRANSITION METAL COMPOUND TO FORM A CATIONIC TRANSITION METAL COMPOUND, ORGANOMETALLIC TO FORM POLYOLEFIN | TOSOH CORPORATION (JP) | 2001-11-13 | — | — | US | disclosed |