⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3852416 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7622518 | 0.65 | — | — | |
| Ethylene SCHEMBL27546064 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL7622516 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL7587415 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL12816509 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL27546201 | 0.65 | — | — | |
| SCHEMBL7624539 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL12816512 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL27546002 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0645401-B1 | Process for producing polyolefins | BASELL POLYOLEFINE GMBH (DE) | 2001-12-05 | — | — | EP | claimed |