⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28114647 | 0.86 | HDAC3 (0.46) | — | |
| SCHEMBL3402335 | 0.81 | HDAC3 (0.50) | — | |
| SCHEMBL3402330 | 0.81 | HDAC3 (0.50) | — | |
| SCHEMBL31065270 | 0.79 | — | — | |
| SCHEMBL6130612 | 0.71 | — | — | |
| SCHEMBL6709788 | 0.71 | — | — | |
| SCHEMBL711958 | 0.69 | — | — | |
| SCHEMBL269648 | 0.69 | — | — | |
| SCHEMBL11783133 | 0.69 | HDAC3 (0.48) | — | |
| SCHEMBL16664 | 0.69 | HDAC3 (0.48) | — |
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-105399947-B | A kind of reactive extrursion preparation method of polyamide 6 copolymer of polyether-type polyurethane | 江苏和伟美科技发展有限公司 | 2018-01-30 | — | — | CN | disclosed |