⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2135043 | 0.94 | CHRNA7 (0.32) | — | |
| SCHEMBL886988 | 0.94 | CHRNA7 (0.32) | — | |
| SCHEMBL2135049 | 0.94 | CHRNA7 (0.32) | — | |
| SCHEMBL886986 | 0.91 | BRD4 (0.31) | — | |
| SCHEMBL13006790 | 0.83 | KMT2A (0.40) | — | |
| SCHEMBL14521797 | 0.83 | CYP2C19 (0.31) | — | |
| SCHEMBL3385488 | 0.83 | KMT2A (0.40) | — | |
| SCHEMBL3386959 | 0.83 | — | — | |
| SCHEMBL13006724 | 0.83 | — | — | |
| SCHEMBL13006712 | 0.82 | S1PR5 (0.30) | — |
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-1436337-A1 | PROCESS FOR THE PREPARATION OF HYDROXY-VINYL-AROMATIC POLYMERS OR COPOLYMERS BY ANIONIC OR CONTROLLED RADICAL POLYMERIZATION | Ciba SC Holding AG (CH) | 2004-07-14 | — | — | EP | disclosed |
| WO-2003022895-A1 | PROCESS FOR THE PREPARATION OF HYDROXY-VINYL-AROMATIC POLYMERS OR COPOLYMERS BY ANIONIC OR CONTROLLED RADICAL POLYMERIZATION | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2003-03-20 | — | — | WO | disclosed |