⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9751384 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL10822776 | 0.94 | — | — | |
| SCHEMBL12448098 | 0.74 | — | — | |
| SCHEMBL23193203 | 0.72 | CETP (0.32) | — | |
| SCHEMBL4770945 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL10822901 | 0.72 | CHRM1 (0.38) | — | |
| SCHEMBL19629810 | 0.70 | — | — | |
| SCHEMBL28033672 | 0.69 | — | — | |
| SCHEMBL3068333 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL2795931 | 0.65 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104952626-B | It is a kind of nanocrystalline to electrode and preparation method thereof | 温州大学 | 2017-12-01 | — | — | CN | claimed |
| CN-104952626-A | Nanocrystalline counter electrode and production method thereof | UNIV WENZHOU | 2015-09-30 | — | — | CN | claimed |
| CN-104952626-B | It is a kind of nanocrystalline to electrode and preparation method thereof | 温州大学 | 2017-12-01 | — | — | CN | disclosed |
| CN-104952626-A | Nanocrystalline counter electrode and production method thereof | UNIV WENZHOU | 2015-09-30 | — | — | CN | disclosed |