⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10821264 | 0.76 | — | — | |
| SCHEMBL16640728 | 0.67 | — | — | |
| SCHEMBL13400618 | 0.64 | GSTP1 (0.33) | — | |
| SCHEMBL20129898 | 0.62 | — | — | |
| SCHEMBL13400619 | 0.60 | — | — | |
| SCHEMBL10042996 | 0.58 | — | — | |
| SCHEMBL16640739 | 0.57 | NFE2L2 (0.30) | — | |
| SCHEMBL16640727 | 0.57 | HIF1A (0.34) | — | |
| SCHEMBL11793671 | 0.55 | — | — | |
| SCHEMBL19021935 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9682111-B2 | Method for preventing or treating neurodegenerative diseases | SU WEIWEI (CN) | 2017-06-20 | — | — | US | disclosed |
| US-9682111-B2 | Method for preventing or treating neurodegenerative diseases | SU WEIWEI (CN) | 2017-06-20 | — | — | US | disclosed |
| US-20160082059-A1 | METHOD FOR PREVENTING OR TREATING NEURODEGENERATIVE DISEASES | SU WEIWEI (CN) | 2016-03-24 | — | — | US | disclosed |
| US-20150105460-A1 | LABDANE DITERPENOID COMPOUNDS, SEMEN BIOTAE EXTRACT, AND PREPARATION METHOD AND USE THEREOF | SU WEIWEI (CN) | 2015-04-16 | — | — | US | disclosed |