⚠ 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 | |
|---|---|---|---|---|
| Ethane SCHEMBL8633242 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL31498257 | 0.79 | CYP19A1 (0.30) | — | |
| SCHEMBL27492992 | 0.78 | CYP19A1 (0.35) | — | |
| SCHEMBL6659310 | 0.78 | CYP19A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL31592075 | 0.77 | CYP19A1 (0.34) | — | |
| Propane SCHEMBL8632264 | 0.77 | — | — | |
| SCHEMBL2844484 | 0.74 | MAOB (0.40) | — | |
| Ethane SCHEMBL8633342 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL7634291 | 0.74 | — | — | |
| SCHEMBL7602769 | 0.74 | RET (0.31) | — |
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 3 patents. 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 |
| EP-0485822-B1 | Process for preparing high molecular weight polyolefines | HOECHST AG (DE) | 1996-07-03 | — | — | EP | claimed |
| EP-0485823-B1 | 2-Substituted bisindenyl-metallocenes, process for their preparation and their use as catalysts for the polymerization of olefins | HOECHST AG (DE) | 1995-03-08 | — | — | EP | claimed |