⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24659006 | 0.79 | — | — | |
| SCHEMBL17391577 | 0.74 | GAA (0.35) | — | |
| SCHEMBL6753796 | 0.71 | ALOX15 (0.32) | — | |
| SCHEMBL10767032 | 0.70 | — | — | |
| SCHEMBL20760234 | 0.68 | — | — | |
| SCHEMBL6547046 | 0.68 | MEN1 (0.30) | — | |
| SCHEMBL9660756 | 0.64 | ALOX15 (0.33) | — | |
| SCHEMBL9049980 | 0.63 | — | — | |
| SCHEMBL10879031 | 0.61 | — | — | |
| SCHEMBL11362586 | 0.60 | PTPN1 (0.31) | — |
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-6165953-A | Dryer added fabric softening compositions and method of use for the delivery of fragrance derivatives | THE PROCTER & GAMBLE COMPANY (US) | 2000-12-26 | — | — | US | claimed |
| US-6100233-A | Odor control compositions comprising β-ketoester pro-fragrances | THE PROCTER & GAMBLE COMPANY (US) | 2000-08-08 | — | — | US | claimed |
| EP-0166080-A1 | Derivative of p-aminophenol with a mucosecretolytic fluidizing and antipyretic activity, process for its preparation and pharmaceutical compositions thereof | CAMILLO CORVI S.p.A. (IT) | 1986-01-02 | — | — | EP | claimed |
| EP-1056702-A1 | TERTIARY ALCOHOL FRAGRANCE RAW MATERIAL DELIVERY SYSTEM | The Procter & Gamble Company (US) | 2000-12-06 | — | — | EP | disclosed |
| WO-1999043639-A1 | TERTIARY ALCOHOL FRAGRANCE RAW MATERIAL DELIVERY SYSTEM | THE PROCTER & GAMBLE COMPANY (US) | 1999-09-02 | — | — | WO | disclosed |