⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1774555 | 0.77 | — | — | |
| SCHEMBL22384680 | 0.66 | XDH (0.34) | — | |
| SCHEMBL7103491 | 0.62 | — | — | |
| SCHEMBL11292655 | 0.58 | — | — | |
| SCHEMBL18946075 | 0.58 | XDH (0.38) | — | |
| SCHEMBL2362073 | 0.58 | — | — | |
| SCHEMBL9995851 | 0.57 | — | — | |
| SCHEMBL468475 | 0.57 | — | — | |
| SCHEMBL7560866 | 0.57 | — | — | |
| SCHEMBL7936015 | 0.56 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1100760-A4 | SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES | BOULDER SCIENT CO (US) | 2002-08-07 | — | — | EP | disclosed |
| EP-1100760-A1 | SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES | BOULDER SCIENTIFIC COMPANY (US) | 2001-05-23 | — | — | EP | disclosed |
| US-6175027-B1 | CONVERTING CYCLOPENTADIENE TO A GRIGNARD REAGENT, THEN REACTING WITH AN ALKYL HALIDE TO PRODUCE MIXTURE OF ALKYL CYCLOPENTADIENE AND MAGNESIUM SALTS; QUENCHING THE MIXTURE WITH AQUEOUS ACETIC ACID TO PRODUCE ALKYL CYCLOPENTADIENE | BOULDER SCIENTIFIC COMPANY | 2001-01-16 | — | — | US | disclosed |
| WO-2000073248-A1 | SYNTHESIS OF BIS(ALKYL CYCLOPENTADIENYL) METALLOCENES | BOULDER SCIENTIFIC COMPANY (US) | 2000-12-07 | — | — | WO | disclosed |