⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1182 | 0.94 | — | — | |
| SCHEMBL8658250 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL591340 | 0.88 | — | — | |
| SCHEMBL11469288 | 0.88 | — | — | |
| SCHEMBL31321023 | 0.88 | — | — | |
| SCHEMBL11848722 | 0.88 | — | — | |
| SCHEMBL135763 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL789487 | 0.88 | — | — | |
| Bromide SCHEMBL2820704 | 0.88 | — | — | |
| SCHEMBL9263434 | 0.88 | ESR2 (0.36) | — |
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-116223472-A | SERS method for rapidly detecting homocysteine | 嘉庚创新实验室 | 2023-06-06 | — | — | CN | claimed |
| CN-116223472-A | SERS method for rapidly detecting homocysteine | 嘉庚创新实验室 | 2023-06-06 | — | — | CN | disclosed |
| CN-104558169-A | Bifunctional antibody serving as positive control in detection of hepatitis C virus | UNIV XINXIANG MEDICAL | 2015-04-29 | — | — | CN | disclosed |