⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL390007 | 0.81 | — | — | |
| SCHEMBL5609222 | 0.77 | — | — | |
| SCHEMBL8361381 | 0.77 | — | — | |
| SCHEMBL5609897 | 0.76 | — | — | |
| SCHEMBL5609860 | 0.76 | — | — | |
| SCHEMBL8361413 | 0.76 | — | — | |
| SCHEMBL690219 | 0.75 | — | — | |
| SCHEMBL5609323 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL8459462 | 0.75 | — | — | |
| SCHEMBL8357774 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5912373-A | Process for converting the achiral meso form of an ansa-metallocene complex into the chiral racemic form | BASF AKTIENGESELLSCHAFT (DE) | 1999-06-15 | — | — | US | disclosed |
| US-5840950-A | Process for converting the achiral meso form or the racemate of an ansa-metallocene complex or mixtures thereof into one of its enantiomers | BASF AKTIENGESELLSCHAFT (DE) | 1998-11-24 | — | — | US | disclosed |
| CN-1190399-A | Process for converting achiral meso form or racemate of ansa-metallocene complex or mixtures thereof into one of its enantiomers | BASF AG (DE) | 1998-08-12 | — | — | CN | disclosed |