⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL59867 | 0.90 | — | — | |
| SCHEMBL21496142 | 0.79 | — | — | |
| Cyclopentane SCHEMBL7722831 | 0.63 | TP53 (0.33) | — | |
| Cyclohexane SCHEMBL28457563 | 0.62 | — | — | |
| SCHEMBL675353 | 0.58 | — | — | |
| Cycloheptane SCHEMBL15066463 | 0.57 | — | — | |
| Cyclohexane SCHEMBL20699509 | 0.57 | LMNA (0.30) | — | |
| Cyclohexane SCHEMBL7778568 | 0.57 | — | — | |
| Cyclopentane SCHEMBL7776639 | 0.57 | — | — | |
| SCHEMBL15067873 | 0.57 | — | — |
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-111554854-A | Preparation method of modified lithium ion battery diaphragm | 林树琦 | 2020-08-18 | — | — | CN | disclosed |