⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4855779 | 0.87 | ALDH1A1 (0.34) | — | |
| SCHEMBL10645290 | 0.86 | — | — | |
| Bromide SCHEMBL28513240 | 0.75 | TSHR (0.30) | — | |
| Iodide SCHEMBL28522450 | 0.75 | TSHR (0.30) | — | |
| SCHEMBL4811260 | 0.75 | — | — | |
| SCHEMBL11647753 | 0.75 | — | — | |
| SCHEMBL669679 | 0.73 | TSHR (0.48) | — | |
| SCHEMBL2510404 | 0.73 | — | — | |
| Water SCHEMBL20450640 | 0.73 | TSHR (0.35) | — | |
| Hydrochloric Acid SCHEMBL10823129 | 0.73 | TSHR (0.35) | — |
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-108373715-B | Coating with formaldehyde purification function and preparation method thereof | 秦素洁 | 2020-06-23 | — | — | CN | claimed |
| CN-107954737-B | Building decoration material with formaldehyde purification function and preparation method thereof | 秦素洁 | 2020-04-17 | — | — | CN | claimed |
| CN-108373715-A | A kind of coating and preparation method thereof with purifying formaldehyde function | 秦素洁 | 2018-08-07 | — | — | CN | claimed |
| CN-108373715-B | Coating with formaldehyde purification function and preparation method thereof | 秦素洁 | 2020-06-23 | — | — | CN | disclosed |
| CN-107954737-B | Building decoration material with formaldehyde purification function and preparation method thereof | 秦素洁 | 2020-04-17 | — | — | CN | disclosed |
| CN-108373715-A | A kind of coating and preparation method thereof with purifying formaldehyde function | 秦素洁 | 2018-08-07 | — | — | CN | disclosed |
| US-6331500-B1 | SHAPE-SELECTIVE ADSORBENTS AND CATALYSTS MODULATED WITH CROSSLINKED SILOXY MONOMERS; MICROPOROSITY | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2001-12-18 | — | — | US | disclosed |
| WO-1999010277-A1 | FUNCTIONALIZED MOLECULAR SIEVES | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1999-03-04 | — | — | WO | disclosed |
| WO-1999002577-A1 | MODIFIED PHENOL-FORMALDEHYDE RESIN AND PROCESS OF MAKING THE SAME | PERSTORP AB (SE) | 1999-01-21 | — | — | WO | disclosed |