⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3280217 | 0.81 | KDM4E (0.37) | — | |
| SCHEMBL5673103 | 0.79 | — | — | |
| SCHEMBL1880926 | 0.78 | HDAC3 (0.31) | — | |
| SCHEMBL3283301 | 0.78 | CES1 (0.41) | — | |
| Acetone SCHEMBL25359225 | 0.75 | TDP1 (0.36) | — | |
| SCHEMBL3280459 | 0.75 | HDAC3 (0.38) | — | |
| SCHEMBL1767666 | 0.74 | — | — | |
| Ethylamine SCHEMBL7592518 | 0.73 | — | — | |
| SCHEMBL29207886 | 0.73 | — | — | |
| SCHEMBL10910411 | 0.72 | TDP1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7700540-B2 | Hard surface cleaning composition | THE CLOROX COMPANY (US) | 2010-04-20 | — | — | US | claimed |
| US-20070099816-A1 | Hard Surface Cleaning Composition | THE CLOROX COMPANY | 2007-05-03 | — | — | US | claimed |
| WO-2023154842-A1 | THR BETA ANALOGS AND USES THEREOF | MADRIGAL PHARMACEUTICALS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |
| US-7700540-B2 | Hard surface cleaning composition | THE CLOROX COMPANY (US) | 2010-04-20 | — | — | US | disclosed |
| US-20070099816-A1 | Hard Surface Cleaning Composition | THE CLOROX COMPANY | 2007-05-03 | — | — | US | disclosed |
| EP-0544933-B1 | A pressure sensitive adhesive composition and a pressure sensitive adhesive sheet, a label and a laminate utilizing it | LINTEC CORP (JP) | 1996-02-07 | — | — | EP | disclosed |
| US-4174152-A | Electrochromic devices with polymeric electrolytes | AMERICAN CYANAMID COMPANY (US) | 1979-11-13 | — | — | US | disclosed |
| US-3990381-A | Hydrophilic polymer coating for underwater structures | NATIONAL PATENT DEVELOPMENT CORPORATION (US) | 1976-11-09 | — | — | US | disclosed |