⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4848656 | 0.92 | — | — | |
| SCHEMBL20503222 | 0.90 | MAPT (0.43) | — | |
| SCHEMBL23895296 | 0.83 | — | — | |
| SCHEMBL5079609 | 0.76 | — | — | |
| SCHEMBL3677002 | 0.75 | TSHR (0.50) | — | |
| SCHEMBL20391090 | 0.74 | — | — | |
| Fluoride SCHEMBL31436429 | 0.74 | TSHR (0.39) | — | |
| SCHEMBL834166 | 0.74 | — | — | |
| SCHEMBL4333454 | 0.74 | — | — | |
| SCHEMBL325130 | 0.72 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118825421-A | Battery cell, battery and electricity utilization device | 宁德时代新能源科技股份有限公司 | 2024-10-22 | — | — | CN | disclosed |
| CN-114057605-B | Method for producing nitrile by gas phase dehydration | 化学与精细化工广东省实验室 | 2024-02-20 | — | — | CN | disclosed |
| CN-1193017-C | rice blast control agent | MEIJI SEIKA KAISHA (JP) | 2005-03-16 | — | — | CN | disclosed |
| CN-1444562-A | Rice blast control agents | MEIJI SEIKA KAISHA (JP) | 2003-09-24 | — | — | CN | disclosed |
| EP-1280861-A2 | SYNTHESIS AND USE OF ACYL FLUORIDES OF CYANINE DYES | Beckman Coulter, Inc. (US) | 2003-02-05 | — | — | EP | disclosed |
| US-6342326-B1 | ACTIVE MATERIAL DYES | BECKMAN COULTER, INC. | 2002-01-29 | — | — | US | disclosed |
| WO-2001085850-A2 | SYNTHESIS AND USE OF ACYL FLUORIDES OF CYANINE DYES | BECKMAN COULTER, INC. (US) | 2001-11-15 | — | — | WO | disclosed |