⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18238841 | 0.74 | — | — | |
| SCHEMBL14643807 | 0.71 | — | — | |
| SCHEMBL9961325 | 0.70 | LMNA (0.37) | — | |
| SCHEMBL15980402 | 0.68 | DYRK1A (0.33) | — | |
| SCHEMBL12687213 | 0.68 | DYRK1A (0.36) | — | |
| SCHEMBL19152915 | 0.65 | CYP1A2 (0.43) | — | |
| SCHEMBL14643810 | 0.65 | CYP1A2 (0.41) | — | |
| SCHEMBL19153805 | 0.64 | — | — | |
| SCHEMBL6837629 | 0.64 | — | — | |
| SCHEMBL12232190 | 0.64 | ALDH1A1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3553056-A1 | (HETERO)ARYLAMIDE COMPOUND FOR INHIBITING PROTEIN KINASE ACTIVITY | Shenzhen Targetrx, Inc. (CN) | 2019-10-16 | — | — | EP | disclosed |
| US-20170202970-A1 | SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME | BLINKBIO, INC. | 2017-07-20 | — | — | US | disclosed |