⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL946122 | 0.88 | — | — | |
| SCHEMBL944955 | 0.85 | KIF11 (0.30) | — | |
| SCHEMBL18315289 | 0.74 | TP53 (0.30) | — | |
| SCHEMBL18261167 | 0.65 | TSHR (0.36) | — | |
| SCHEMBL5006653 | 0.63 | NPC1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL4241154 | 0.63 | CYP19A1 (0.34) | — | |
| SCHEMBL944815 | 0.62 | CYP19A1 (0.34) | — | |
| SCHEMBL27499468 | 0.62 | — | — | |
| SCHEMBL5008828 | 0.61 | CYP19A1 (0.36) | — | |
| SCHEMBL16913287 | 0.61 | ESR1 (0.38) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110251400-A1 | Preparation of Dphenyl-Bridged Substituted Cyclopentadienyil-Fluorenyl Ligands | TOTAL PETROCHEMICALS RESEARCH FELUY (BE) | 2011-10-13 | — | — | US | disclosed |
| EP-2069372-B1 | PREPARATION OF DIPHENYL-BRIDGED SUBSTITUTED CYCLOPENTADIENYL-FLUORENYL LIGANDS | TOTAL PETROCHEMICALS RES FELUY (BE) | 2011-08-03 | — | — | EP | disclosed |
| US-20110003953-A1 | Carbon-Bridged Cyclopentadienyl-Fluorenyl Ligands | FINA TECHNOLOGY, INC. (US) | 2011-01-06 | — | — | US | disclosed |
| EP-1903061-A1 | Preparation of diphenyl-bridged substituted cyclopentadienyl-fluorenyl ligands | TOTAL PETROCHEMICALS RESEARCH FELUY (BE) | 2008-03-26 | — | — | EP | disclosed |
| EP-1734059-A1 | Carbon-bridged cyclopentadienyl-fluorenyl ligands | TOTAL PETROCHEMICALS RESEARCH FELUY (BE) | 2006-12-20 | — | — | EP | disclosed |