⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16922260 | 0.85 | — | — | |
| SCHEMBL28027939 | 0.77 | ALDH1A1 (0.67) | — | |
| SCHEMBL175249 | 0.77 | ALDH1A1 (0.67) | — | |
| Formic Acid SCHEMBL31678789 | 0.75 | ALDH1A1 (0.53) | — | |
| SCHEMBL18153600 | 0.75 | JAK2 (0.51) | — | |
| SCHEMBL18153601 | 0.75 | JAK2 (0.51) | — | |
| SCHEMBL2170448 | 0.75 | — | — | |
| SCHEMBL121301 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL27980177 | 0.75 | ALDH1A1 (0.64) | — | |
| SCHEMBL10285238 | 0.74 | ALDH1A1 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104870429-A | Benzofuran derivative, preparation method therefor, and medical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-08-26 | — | — | CN | claimed |
| CN-104870429-A | Benzofuran derivative, preparation method therefor, and medical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2015-08-26 | — | — | CN | disclosed |