⚠ 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 SCHEMBL8333144 | 0.80 | — | — | |
| SCHEMBL248626 | 0.78 | — | — | |
| SCHEMBL8468834 | 0.77 | — | — | |
| SCHEMBL9440317 | 0.77 | — | — | |
| SCHEMBL9145372 | 0.76 | — | — | |
| SCHEMBL5604028 | 0.76 | — | — | |
| SCHEMBL9144681 | 0.76 | — | — | |
| SCHEMBL10708910 | 0.75 | — | — | |
| SCHEMBL6053807 | 0.75 | — | — | |
| SCHEMBL8678699 | 0.75 | — | — |
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-6197985-B1 | METALLOCENE SUPPORTS; OLEFIN POLYMERIZATION CATALYSTS | MITSUI CHEMICALS INC (JP) | 2001-03-06 | — | — | US | disclosed |