⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16102898 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL16104944 | 0.88 | TAAR1 (0.41) | — | |
| SCHEMBL17499200 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL17499584 | 0.85 | SLC6A2 (0.33) | — | |
| SCHEMBL17499317 | 0.85 | BCHE (0.32) | — | |
| SCHEMBL17499557 | 0.84 | NR4A1 (0.39) | — | |
| SCHEMBL17499185 | 0.81 | MEN1 (0.37) | — | |
| SCHEMBL16095976 | 0.81 | ABCB1 (0.33) | — | |
| SCHEMBL16097198 | 0.78 | ABCB1 (0.36) | — | |
| SCHEMBL17499343 | 0.77 | SIGMAR1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2969593-B1 | POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES | BRIDGESTONE CORP (JP) | 2020-11-04 | — | — | EP | disclosed |
| US-9850328-B2 | Polymers functionalized with heterocyclic imines | BRIDGESTONE CORPORATION (JP) | 2017-12-26 | — | — | US | disclosed |
| US-20160039958-A1 | Polymers Functionalized With Heterocyclic Imines | BRIDGESTONE CORPORATION (JP) | 2016-02-11 | — | — | US | disclosed |