⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9496990 | 0.97 | MMP2 (0.33) | — | |
| SCHEMBL9492749 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9494151 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9494740 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9493183 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9497790 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9493544 | 0.96 | MMP2 (0.35) | — | |
| SCHEMBL9497149 | 0.95 | — | — | |
| SCHEMBL9494361 | 0.94 | MMP2 (0.36) | — | |
| SCHEMBL9494043 | 0.93 | MMP2 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0329752-B1 | FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS | MERCK PATENT GmbH (DE) | 1993-03-17 | — | — | EP | disclosed |
| EP-0329752-A1 | FLUORINATED OLIGOPHENYLS AND THEIR USE IN LIQUID CRYSTAL MATERIALS | MERCK PATENT GmbH (DE) | 1989-08-30 | — | — | EP | disclosed |