⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5846496 | 0.75 | — | — | |
| SCHEMBL18946075 | 0.70 | XDH (0.38) | — | |
| SCHEMBL8991888 | 0.67 | POLB (0.31) | — | |
| SCHEMBL11059191 | 0.66 | — | — | |
| SCHEMBL3807551 | 0.64 | STAT3 (0.33) | — | |
| SCHEMBL20015398 | 0.63 | GABRA1 (0.32) | — | |
| SCHEMBL7145883 | 0.63 | — | — | |
| SCHEMBL7529056 | 0.63 | — | — | |
| SCHEMBL2150852 | 0.62 | XDH (0.31) | — | |
| SCHEMBL10827947 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0994176-B1 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INT FLAVORS & FRAGRANCES INC (US) | 2004-01-28 | — | — | EP | claimed |
| EP-0994176-A2 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2000-04-19 | — | — | EP | claimed |
| EP-0994176-B1 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INT FLAVORS & FRAGRANCES INC (US) | 2004-01-28 | — | — | EP | disclosed |
| EP-0994176-A3 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2001-05-02 | — | — | EP | disclosed |
| US-6090774-A | CONSISTS OF ATLEAST TWO SUBSTANCES SELECTED FROM DERIVATIVES OF COUMARIN, VANILLIN, RESORCYLIC ACID, METHYLENE DIOXYBENZENE, POLYCYCLIC MUSKS, ARYL ALKANOIC ACIDS AND P-OXOALKYLPHENOLS, USED IN ENHANCING THE AROMA OF PERFUME | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2000-07-18 | — | — | US | disclosed |
| US-6090774-A | CONSISTS OF ATLEAST TWO SUBSTANCES SELECTED FROM DERIVATIVES OF COUMARIN, VANILLIN, RESORCYLIC ACID, METHYLENE DIOXYBENZENE, POLYCYCLIC MUSKS, ARYL ALKANOIC ACIDS AND P-OXOALKYLPHENOLS, USED IN ENHANCING THE AROMA OF PERFUME | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2000-07-18 | — | — | US | disclosed |
| EP-0994176-A2 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2000-04-19 | — | — | EP | disclosed |
| EP-0994176-A2 | Single phase liquid mixture of benzophenone and mixture of at least two other normally solid perfumery substances and perfumery uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2000-04-19 | — | — | EP | disclosed |