⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL931235 | 1.00 | — | — | |
| SCHEMBL106941 | 0.93 | TSHR (0.30) | — | |
| Hydroxyl Radical SCHEMBL28871487 | 0.90 | TSHR (0.32) | — | |
| SCHEMBL22654233 | 0.89 | — | — | |
| Butane SCHEMBL28187655 | 0.87 | TSHR (0.30) | — | |
| SCHEMBL27823328 | 0.87 | — | — | |
| SCHEMBL22548 | 0.87 | — | — | |
| SCHEMBL931900 | 0.86 | TSHR (0.36) | — | |
| SCHEMBL929651 | 0.86 | TSHR (0.36) | — | |
| SCHEMBL7583255 | 0.85 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101798369-A | Silicone-acrylic emulsion with high silicon content and preparation method thereof | BEIJING COMENS NEW MAT CO LTD | 2010-08-11 | — | — | CN | claimed |
| CN-115044310-A | Hot-melt foaming film suitable for aluminum-based composite board and preparation method and application thereof | 江苏鹿山新材料有限公司 | 2022-09-13 | — | — | CN | disclosed |
| CN-110157298-B | Modified epoxy resin sealant and preparation method thereof | 上海凯矜新材料科技有限公司 | 2021-04-09 | — | — | CN | disclosed |
| CN-101798369-A | Silicone-acrylic emulsion with high silicon content and preparation method thereof | BEIJING COMENS NEW MAT CO LTD | 2010-08-11 | — | — | CN | disclosed |
| US-5859123-A | ONE-PACKAGE PAINTS; PREPARED BY POLYMERIZING A FLUOROOLEFIN, AN ORGANOSILICON COMPOUND, AN UNSATURATED CARBOXYLIC ACID, AND A COPOLYMERIZABLE MONOMER | CENTRAL GLASS COMPANY, LIMITED (JP) | 1999-01-12 | — | — | US | disclosed |