⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21903083 | 0.87 | NFKB1 (0.33) | — | |
| SCHEMBL21903082 | 0.87 | NFKB1 (0.33) | — | |
| SCHEMBL2639497 | 0.82 | FFAR1 (0.33) | — | |
| SCHEMBL586079 | 0.82 | FFAR1 (0.33) | — | |
| SCHEMBL873099 | 0.82 | FFAR1 (0.33) | — | |
| SCHEMBL873097 | 0.82 | FFAR1 (0.33) | — | |
| SCHEMBL16390697 | 0.79 | — | — | |
| SCHEMBL7714361 | 0.76 | CMKLR1 (0.32) | — | |
| SCHEMBL7714358 | 0.76 | CMKLR1 (0.32) | — | |
| SCHEMBL7127815 | 0.76 | CMKLR1 (0.32) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106660230-A | Metal mold for in-mold foam molding of polyolefin resin, method for producing in-mold foam molded article, and in-mold foam molded article | 株式会社钟化 | 2017-05-10 | — | — | CN | disclosed |
| CN-102249872-B | Method for producing aldehyde and ketone | SHINETSU CHEMICAL CO | 2014-06-18 | — | — | CN | disclosed |
| CN-103772082-A | Method for preparing aldehyde or ketone by oxidizing alcohol by using oxygen | UNIV EAST CHINA NORMAL | 2014-05-07 | — | — | CN | disclosed |
| CN-102336619-B | Method for preparing aldehyde or ketone by oxidizing alcohol with oxygen | UNIV EAST CHINA NORMAL | 2014-01-29 | — | — | CN | disclosed |
| CN-101035823-B | Amphiphilic star block copolymers | FIRMENICH & CIE | 2012-07-04 | — | — | CN | disclosed |
| CN-102336619-A | Method for preparing aldehyde or ketone by oxidizing alcohol with oxygen | UNIV EAST CHINA NORMAL | 2012-02-01 | — | — | CN | disclosed |
| CN-102249872-A | Method for producing aldehyde and ketone | SHINETSU CHEMICAL CO | 2011-11-23 | — | — | CN | disclosed |
| CN-102089037-A | Equilibrium dynamic mixtures containing stabilized hemiacetals for controlled release of active alcohols | FIRMENICH & CIE | 2011-06-08 | — | — | CN | disclosed |
| CN-101035823-A | Amphiphilic star block copolymers | FIRMENICH & CIE (CH) | 2007-09-12 | — | — | CN | disclosed |
| CN-1178889-C | Polyhydroxyphenol derivatives and preventive and therapeutic agents for bone and cartilage diseases containing the same | ��³����ʽ���� | 2004-12-08 | — | — | CN | disclosed |
| CN-1225082-A | Polyhydroxyphenol derivatives and preventive and therapeutic agents for bone and cartilage diseases containing the same | HESS MARYON ROUSSEAU K K (JP) | 1999-08-04 | — | — | CN | disclosed |