⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8411426 | 0.91 | — | — | |
| SCHEMBL3998523 | 0.88 | MEN1 (0.31) | — | |
| SCHEMBL8408374 | 0.84 | GSTP1 (0.31) | — | |
| SCHEMBL7006278 | 0.83 | GSTP1 (0.35) | — | |
| SCHEMBL3818126 | 0.79 | PDCD1 (0.31) | — | |
| SCHEMBL4001907 | 0.78 | PDCD1 (0.30) | — | |
| SCHEMBL7262251 | 0.78 | — | — | |
| SCHEMBL4622630 | 0.77 | SLC6A4 (0.34) | — | |
| SCHEMBL8165812 | 0.76 | BRD4 (0.31) | — | |
| SCHEMBL6258160 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0930320-A1 | ETHYLENE/ALPHA-OLEFIN COPOLYMERS, COMPOSITIONS, AND PROCESSES FOR THE PREPARATION OF THE COPOLYMERS AND THE COMPOSITIONS | Mitsui Chemicals, Inc. (JP) | 1999-07-21 | — | — | EP | disclosed |