⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20761450 | 0.81 | CYP3A4 (0.31) | — | |
| SCHEMBL8130332 | 0.71 | GRIK1 (0.31) | — | |
| SCHEMBL20334682 | 0.71 | — | — | |
| SCHEMBL26668060 | 0.70 | — | — | |
| SCHEMBL12654256 | 0.70 | BACE1 (0.34) | — | |
| SCHEMBL8407701 | 0.69 | BACE1 (0.32) | — | |
| SCHEMBL8407699 | 0.69 | BACE1 (0.32) | — | |
| SCHEMBL11208719 | 0.65 | — | — | |
| SCHEMBL19687931 | 0.65 | — | — | |
| SCHEMBL4054391 | 0.64 | BACE1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103224667-B | Fiber polypropylene resin composite for filling, molded body, automobile inner panel parts | 住友化学株式会社 | 2016-08-03 | — | — | CN | disclosed |