⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7811921 | 0.79 | — | — | |
| SCHEMBL56411 | 0.74 | — | — | |
| SCHEMBL10653580 | 0.71 | — | — | |
| Water SCHEMBL28188005 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL284066 | 0.70 | — | — | |
| SCHEMBL3374972 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5211248 | 0.70 | — | — | |
| SCHEMBL9503195 | 0.70 | — | — | |
| SCHEMBL24660373 | 0.69 | — | — | |
| SCHEMBL24864774 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111228212-A | Drug-loaded injectable implantation in-situ hydrogel | 中国人民解放军军事科学院军事医学研究院 | 2020-06-05 | — | — | CN | disclosed |
| WO-2020065673-A1 | SYNERGISTIC INSECTICIDAL COMPOSITIONS OF NITENPYRAM | WILLOWOOD CHEMICALS PRIVATE LIMITED (IN) | 2020-04-02 | — | — | WO | disclosed |
| US-5817712-A | Self-crosslinking aqueous dispersions of polyesters and vinyl polymers | VIANOVA RESINS GMBH (DE) | 1998-10-06 | — | — | US | disclosed |