⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15283726 | 0.83 | TSHR (0.39) | — | |
| SCHEMBL3214567 | 0.80 | — | — | |
| SCHEMBL737214 | 0.76 | TSHR (0.44) | — | |
| SCHEMBL9090874 | 0.71 | — | — | |
| SCHEMBL17414 | 0.71 | — | — | |
| SCHEMBL4297898 | 0.71 | — | — | |
| SCHEMBL9618476 | 0.70 | HMGCR (0.34) | — | |
| SCHEMBL3227536 | 0.69 | — | — | |
| SCHEMBL3792842 | 0.69 | — | — | |
| SCHEMBL4936713 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230108403-A1 | COMPOSITIONS AND SYSTEMS FOR DISINFECTION | Markesbery Blue Pearl LLC | 2023-04-06 | — | — | US | disclosed |
| EP-4114177-A1 | COMPOSITIONS AND SYSTEMS FOR DISINFECTION | Markesbery Blue Pearl LLC (US) | 2023-01-11 | — | — | EP | disclosed |
| WO-2021178774-A1 | COMPOSITIONS AND SYSTEMS FOR DISINFECTION | PANCHERI EUGENE J (US) | 2021-09-10 | — | — | WO | disclosed |
| US-20100009927-A1 | Anti-Inflammatory and Anti-Allergy Extracts from Nettle | HERBALSCIENCE GROUP LLC (US) | 2010-01-14 | — | — | US | disclosed |
| US-5091488-A | POLYETHYLACETYLENE DERIVATIVE AND PROCESS FOR PREPARATION THEREOF | DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 1992-02-25 | — | — | US | disclosed |