⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21564 | 0.79 | TSHR (0.32) | — | |
| SCHEMBL28466015 | 0.73 | — | — | |
| SCHEMBL1719957 | 0.73 | — | — | |
| SCHEMBL165076 | 0.71 | — | — | |
| SCHEMBL28418661 | 0.71 | — | — | |
| SCHEMBL10365031 | 0.71 | — | — | |
| SCHEMBL4800433 | 0.69 | — | — | |
| SCHEMBL27924959 | 0.69 | — | — | |
| SCHEMBL10584165 | 0.69 | — | — | |
| SCHEMBL28065958 | 0.65 | TSHR (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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110721661-B | Preparation method of efficient adsorption and catalysis dual-function hypha material | 西南科技大学 | 2022-03-25 | — | — | CN | claimed |
| CN-111992179-A | Chemically modified graphene oxide ionic sewage treatment agent and preparation method thereof | 山东尚科环境工程有限公司 | 2020-11-27 | — | — | CN | claimed |
| CN-110721661-A | Preparation method of efficient adsorption and catalysis dual-function hypha material | 西南科技大学 | 2020-01-24 | — | — | CN | claimed |
| CN-106167285-A | A kind of chemical modification graphene oxide ion-type sewage-treating agent and preparation method | 合众（佛山）化工有限公司 | 2016-11-30 | — | — | CN | claimed |
| CN-110721661-B | Preparation method of efficient adsorption and catalysis dual-function hypha material | 西南科技大学 | 2022-03-25 | — | — | CN | disclosed |
| CN-111992179-A | Chemically modified graphene oxide ionic sewage treatment agent and preparation method thereof | 山东尚科环境工程有限公司 | 2020-11-27 | — | — | CN | disclosed |
| CN-111992179-A | Chemically modified graphene oxide ionic sewage treatment agent and preparation method thereof | 山东尚科环境工程有限公司 | 2020-11-27 | — | — | CN | disclosed |
| CN-110721661-A | Preparation method of efficient adsorption and catalysis dual-function hypha material | 西南科技大学 | 2020-01-24 | — | — | CN | disclosed |
| CN-106167285-A | A kind of chemical modification graphene oxide ion-type sewage-treating agent and preparation method | 合众（佛山）化工有限公司 | 2016-11-30 | — | — | CN | disclosed |