⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15374809 | 0.78 | — | — | |
| SCHEMBL682142 | 0.74 | ALDH1A1 (0.56) | — | |
| SCHEMBL2777671 | 0.74 | ALDH1A1 (0.31) | — | |
| Cyanate SCHEMBL10596478 | 0.72 | ESR1 (0.32) | — | |
| SCHEMBL1081191 | 0.72 | ALDH1A1 (0.34) | — | |
| SCHEMBL264479 | 0.69 | ALDH1A1 (0.54) | — | |
| SCHEMBL20717168 | 0.69 | — | — | |
| SCHEMBL4912979 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL8616101 | 0.68 | ALDH1A1 (0.32) | — | |
| SCHEMBL9848778 | 0.68 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11690380-B2 | Antimicrobial guanidinium and thiouronium functionalized polymers | CORAL BAY II, LLC (US) | 2023-07-04 | — | — | US | disclosed |
| US-9854806-B2 | Antimicrobial guanidinium and thiouronium functionalized polymers | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2018-01-02 | — | — | US | disclosed |
| US-20170303541-A1 | ANTIMICROBIAL GUANIDINIUM AND THIOURONIUM FUNCTIONALIZED POLYMERS | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2017-10-26 | — | — | US | disclosed |
| US-20160338356-A1 | ANTIMICROBIAL GUANIDINIUM AND THIOURONIUM FUNCTIONALIZED POLYMERS | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2016-11-24 | — | — | US | disclosed |
| EP-0696273-A1 | CARBAMOYL HYDROXYLAMINE AND USE THEREOF IN POLYMER CHEMISTRY | BASF AG (DE) | 1996-02-14 | — | — | EP | disclosed |
| WO-1994025433-A1 | CARBAMOYL HYDROXYLAMINE AND USE THEREOF IN POLYMER CHEMISTRY | BASF AKTIENGESELLSCHAFT (DE) | 1994-11-10 | — | — | WO | disclosed |