⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6662318 | 1.00 | TSHR (0.58) | — | |
| SCHEMBL6665800 | 1.00 | TSHR (0.58) | — | |
| Cyclopropane Carboxylic Acid SCHEMBL32889332 | 0.96 | — | — | |
| SCHEMBL26833 | 0.96 | TSHR (0.61) | — | |
| Cyclopropane Carboxylic Acid SCHEMBL10800712 | 0.96 | — | — | |
| Cyclopropane Carboxylic Acid SCHEMBL5499291 | 0.96 | — | — | |
| SCHEMBL36093 | 0.96 | TSHR (0.61) | — | |
| Cyclopropane Carboxylic Acid SCHEMBL4643 | 0.96 | — | — | |
| SCHEMBL329128 | 0.96 | TSHR (0.61) | — | |
| SCHEMBL196124 | 0.96 | TSHR (0.61) | — |
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-115651743-B | Lubricating composition capable of forming graphene in situ, and preparation method and application thereof | 中国科学院兰州化学物理研究所 | 2023-09-22 | — | — | CN | disclosed |
| CN-115651743-A | Lubricating composition capable of forming graphene in situ and preparation method and application thereof | 中国科学院兰州化学物理研究所 | 2023-01-31 | — | — | CN | disclosed |