⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27628761 | 0.82 | — | — | |
| SCHEMBL4876858 | 0.81 | — | — | |
| SCHEMBL27537187 | 0.79 | — | — | |
| SCHEMBL2842203 | 0.79 | — | — | |
| SCHEMBL987812 | 0.79 | — | — | |
| SCHEMBL27593578 | 0.79 | — | — | |
| SCHEMBL27568449 | 0.77 | — | — | |
| SCHEMBL5001512 | 0.77 | — | — | |
| SCHEMBL27519488 | 0.72 | — | — | |
| SCHEMBL27536291 | 0.71 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101084186-B | Isocyanate compound and process for producing the same, and reactive monomer, reactive (meth)acrylate polymer and its use | SHOWA DENKO KK | 2011-05-11 | — | — | CN | disclosed |
| CN-101084186-A | Ethylenically unsaturated group-containing isocyanate compound and process for producing the same, and reactive monomer, reactive (meth)acrylate polymer and its use | SHOWA DENKO KK (JP) | 2007-12-05 | — | — | CN | disclosed |
| CN-1096464-C | 2, 3-benzodiazepine * derivatives, their preparation and intermediates and their use as pharmaceuticals | SHCERING AG (DE) | 2002-12-18 | — | — | CN | disclosed |
| CN-1210538-A | 2, 3-benzodiazepine * derivatives, their preparation and use as medicaments | SHCERING AG (DE) | 1999-03-10 | — | — | CN | disclosed |
| CN-1118138-A | Substituted azolone derivatives for treating diseases caused by helicobacter | JANSSEN PHARMACEUTICA NV (BE) | 1996-03-06 | — | — | CN | disclosed |
| CN-1027692-C | Process for producing dienamide derivative | ROUSSEL UCLAF CO (FR) | 1995-02-22 | — | — | CN | disclosed |
| CN-1091423-A | The pesticide composition that contains derivative of diene amide | WELLCOME FOUND (GB) | 1994-08-31 | — | — | CN | disclosed |
| CN-1045576-A | Pesticide | WELLCOME FOUND (GB) | 1990-09-26 | — | — | CN | disclosed |