⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27484788 | 0.67 | — | — | |
| SCHEMBL6652488 | 0.64 | TSHR (0.40) | — | |
| Fumaric Acid SCHEMBL28649206 | 0.55 | TSHR (0.64) | — | |
| Maleic Acid SCHEMBL344893 | 0.55 | TSHR (0.64) | — | |
| Fumaric Acid SCHEMBL28927062 | 0.55 | TSHR (0.64) | — | |
| Maleic Acid SCHEMBL28518240 | 0.55 | TSHR (0.64) | — | |
| Fumaric Acid SCHEMBL20455851 | 0.55 | TSHR (0.64) | — | |
| Maleic Acid SCHEMBL31157949 | 0.55 | TSHR (0.64) | — | |
| Fumaric Acid SCHEMBL30271 | 0.55 | TSHR (0.64) | — | |
| Fumaric Acid SCHEMBL29595491 | 0.55 | TSHR (0.64) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105148750-A | Method for modifying surface of polyamide composite film | UNIV ZHEJIANG | 2015-12-16 | — | — | CN | disclosed |