⚠ 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 | |
|---|---|---|---|---|
| Propane SCHEMBL27735195 | 0.91 | — | — | |
| Propane SCHEMBL8444696 | 0.91 | — | — | |
| Propane SCHEMBL7997861 | 0.91 | TSHR (0.38) | — | |
| Propane SCHEMBL787113 | 0.91 | TSHR (0.38) | — | |
| Propane SCHEMBL7708559 | 0.91 | — | — | |
| Propane SCHEMBL11764249 | 0.91 | TSHR (0.38) | — | |
| Propane SCHEMBL787112 | 0.91 | TSHR (0.38) | — | |
| Propane SCHEMBL28758767 | 0.91 | — | — | |
| Propane SCHEMBL28670151 | 0.91 | — | — | |
| Propane SCHEMBL9837149 | 0.91 | — | — |
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-103656691-B | A kind of ultrasonic/preparation method of fluorescent dual module state microcapsules contrast preparation | NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) | 2016-05-18 | — | — | CN | disclosed |