⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6424486 | 0.86 | — | — | |
| SCHEMBL2928417 | 0.83 | — | — | |
| SCHEMBL2253222 | 0.79 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL13057768 | 0.78 | — | — | |
| SCHEMBL27542300 | 0.77 | LMNA (0.33) | — | |
| SCHEMBL10331156 | 0.76 | TSHR (0.52) | — | |
| SCHEMBL2928416 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL1054599 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL2929200 | 0.73 | — | — | |
| SCHEMBL804830 | 0.73 | — | — |
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-1386924-B1 | MONOMER, POLYMER, AND OCULAR LENS AND CONTACT LENS EACH OBTAINED THEREFROM | JOHNSON & JOHNSON VISION CARE (US) | 2009-06-10 | — | — | EP | disclosed |
| EP-1386924-A1 | MONOMER, POLYMER, AND OCULAR LENS AND CONTACT LENS EACH OBTAINED THEREFROM | Johnson & Johnson Vision Care, Inc. (US) | 2004-02-04 | — | — | EP | disclosed |