⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2905525 | 0.80 | — | — | |
| SCHEMBL30150835 | 0.79 | — | — | |
| SCHEMBL8438950 | 0.77 | — | — | |
| SCHEMBL39334 | 0.76 | — | — | |
| SCHEMBL3850375 | 0.68 | — | — | |
| SCHEMBL31327424 | 0.67 | — | — | |
| SCHEMBL29091535 | 0.66 | DNTT (0.31) | — | |
| SCHEMBL28309929 | 0.65 | — | — | |
| SCHEMBL19183339 | 0.64 | — | — | |
| SCHEMBL29799254 | 0.63 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105586322-B | A kind of composition and its depolymerization method for lignocellulosic depolymerisation | 中国科学院天津工业生物技术研究所 | 2019-03-22 | — | — | CN | disclosed |
| CN-105586322-A | Composition for disaggregating lignocelluloses and method for disaggregating lignocelluloses by virtue of composition | TIANJIN INST IND BIOTECHNOLOGY CAS | 2016-05-18 | — | — | CN | disclosed |
| US-5286702-A | Color coupler for infrared recording | YAMADA CHEMICAL CO., LTD. (JP) | 1994-02-15 | — | — | US | disclosed |