⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18395671 | 1.00 | — | — | |
| SCHEMBL18394902 | 0.84 | HPGD (0.35) | — | |
| SCHEMBL18394794 | 0.84 | HPGD (0.35) | — | |
| SCHEMBL18394793 | 0.84 | HPGD (0.35) | — | |
| SCHEMBL18396155 | 0.82 | MAPT (0.38) | — | |
| SCHEMBL18394627 | 0.82 | MAPT (0.38) | — | |
| SCHEMBL18395950 | 0.80 | — | — | |
| SCHEMBL18395952 | 0.80 | — | — | |
| SCHEMBL18394867 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL18394866 | 0.79 | ALDH1A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10077323-B2 | Polymers functionalized with imine compounds containing a protected thiol group | BRIDGESTONE CORPORATION (JP) | 2018-09-18 | — | — | US | disclosed |
| US-20170022301-A1 | POLYMERS FUNCTIONALIZED WITH IMINE COMPOUNDS CONTAINING A PROTECTED THIOL GROUP | BRIDGESTONE CORPORATION (JP) | 2017-01-26 | — | — | US | disclosed |