⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1019271 | 0.80 | — | — | |
| SCHEMBL5967203 | 0.75 | — | — | |
| SCHEMBL9117457 | 0.73 | — | — | |
| SCHEMBL9633594 | 0.73 | — | — | |
| SCHEMBL26458 | 0.72 | — | — | |
| SCHEMBL10723562 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL18396845 | 0.69 | — | — | |
| SCHEMBL8474678 | 0.69 | — | — | |
| SCHEMBL270257 | 0.69 | — | — | |
| SCHEMBL1044624 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113413247-B | Multidirectional optical functionalization instrument for modifying surface of titanium alloy implant and using method thereof | 北京索菲斯医疗器械有限公司 | 2022-05-20 | — | — | CN | disclosed |
| CN-113413247-A | Multidirectional optical functionalization instrument for modifying surface of titanium alloy implant and using method thereof | 尹川 | 2021-09-21 | — | — | CN | disclosed |