⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28577296 | 0.74 | KDM1A (0.41) | — | |
| SCHEMBL28558685 | 0.63 | CHRM2 (0.36) | — | |
| SCHEMBL28362728 | 0.62 | — | — | |
| SCHEMBL6573456 | 0.62 | TSHR (0.35) | — | |
| SCHEMBL3263252 | 0.62 | HSD11B1 (0.36) | — | |
| SCHEMBL2048189 | 0.61 | OPRM1 (0.33) | — | |
| SCHEMBL182247 | 0.60 | OPRM1 (0.35) | — | |
| SCHEMBL28238211 | 0.60 | CHRNB2 (0.31) | — | |
| SCHEMBL18126 | 0.59 | HSD11B1 (0.36) | — | |
| SCHEMBL2232620 | 0.59 | OPRM1 (0.34) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109431963-B | Transparent oil bead suspension essence water and preparation method thereof | 蓓悠清(广东)健康科技有限公司 | 2021-10-26 | — | — | CN | claimed |
| CN-111433256-B | Organic group-modified silicone resin, method for producing same, and cosmetic | 信越化学工业株式会社 | 2022-08-23 | — | — | CN | disclosed |
| CN-108623809-B | Organic group-modified silicone resin, method for producing same, and cosmetic | 信越化学工业株式会社 | 2022-03-15 | — | — | CN | disclosed |
| CN-109414396-B | Cosmetic preparation | 信越化学工业株式会社 | 2021-10-29 | — | — | CN | disclosed |
| CN-109431963-B | Transparent oil bead suspension essence water and preparation method thereof | 蓓悠清(广东)健康科技有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-111433256-A | Organic group-modified silicone resin, method for producing same, and cosmetic | 信越化学工业株式会社 | 2020-07-17 | — | — | CN | disclosed |