⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28040309 | 0.99 | — | — | |
| SCHEMBL16095925 | 0.86 | ACHE (0.37) | — | |
| SCHEMBL17499248 | 0.86 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL17499804 | 0.85 | — | — | |
| SCHEMBL16098038 | 0.85 | — | — | |
| SCHEMBL17499268 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL17499384 | 0.81 | HRH1 (0.33) | — | |
| SCHEMBL28210117 | 0.80 | HRH1 (0.33) | — | |
| SCHEMBL17499702 | 0.80 | PKM (0.37) | — | |
| SCHEMBL16096529 | 0.79 | — | — |
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 |