⚠ 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 | |
|---|---|---|---|---|
| Furfural SCHEMBL626705 | 0.97 | ALDH1A1 (1.00) | — | |
| Furfural SCHEMBL10811266 | 0.97 | ALDH1A1 (1.00) | — | |
| Furfural SCHEMBL20439 | 0.97 | — | — | |
| Furfural SCHEMBL29854165 | 0.95 | — | — | |
| Furfural SCHEMBL11720194 | 0.95 | — | — | |
| Furfural SCHEMBL29491010 | 0.95 | — | — | |
| Furfural SCHEMBL2978794 | 0.95 | — | — | |
| Furfural SCHEMBL896786 | 0.95 | ALDH1A1 (0.95) | — | |
| Furfural SCHEMBL11763411 | 0.95 | — | — | |
| Furfural SCHEMBL28976274 | 0.95 | — | — |
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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101513329-A | Oxygen infusion control for coffee container | KRAFT FOODS GLOBAL BRANDS LLC (US) | 2009-08-26 | — | — | CN | claimed |
| US-4378380-A | DRYING AQUEOUS SOLUTION OF METHYL MERCAPTAN, ACETALDEHYDE, ALKANE ALDEHYDE, AND 2,3-BUTADIONE OR 2,3-PENTANEDIONE WITH FIXATIVE; DRYING FURFURYL MERCAPTAN WITH FIXATIVE; AND MIXING | GENERAL FOODS CORPORATION (US) | 1983-03-29 | — | — | US | claimed |
| CN-110894063-B | Mixed solvent for extracting elemental sulfur in wet-process zinc-smelting sulfur slag and application thereof | 广东利昌新材料有限公司 | 2021-10-08 | — | — | CN | disclosed |
| CN-110894063-A | Mixed solvent for extracting elemental sulfur in wet-process zinc-smelting sulfur slag and application thereof | 曾纪斌 | 2020-03-20 | — | — | CN | disclosed |
| US-10280130-B2 | Polyisobutylene-based thermoplastic elastomers | THE UNIVERSITY OF AKRON (US) | 2019-05-07 | — | — | US | disclosed |
| EP-3440942-A1 | FOOD AND BEVERAGE PRODUCTS CONTAINING 1,3-PROPANEDIOL AND METHODS OF MODIFYING FLAVOR RELEASE USING 1,3-PROPANEDIOL | Kraft Foods Group Brands LLC (US) | 2019-02-13 | — | — | EP | disclosed |
| EP-2822399-B1 | BEVERAGE PRODUCTS CONTAINING 1,3-PROPANEDIOL AND METHODS OF MODIFYING FLAVOR RELEASE USING 1,3-PROPANEDIOL | KRAFT FOODS GROUP BRANDS LLC (US) | 2018-10-31 | — | — | EP | disclosed |
| US-20180116267-A1 | Food And Beverage Products Containing 1,3-Propanediol And Methods Of Modifying Flavor Release Using 1,3-Propanediol | KRAFT FOODS GROUP BRANDS LLC | 2018-05-03 | — | — | US | disclosed |
| EP-2188216-B1 | PROCESS FOR TREATING PULP MILL CONDENSATES USING A HOLLOW FIBER CONTACTOR | FPINNOVATIONS (CA) | 2018-04-25 | — | — | EP | disclosed |
| US-9883691-B2 | Food and beverage products containing 1,3-propanediol and methods of modifying flavor release using 1,3-propanediol | KRAFT FOODS GROUP BRANDS LLC (US) | 2018-02-06 | — | — | US | disclosed |
| US-20170240493-A1 | NOVEL POLYISOBUTYLENE-BASED THERMOPLASTIC ELASTOMERS | THE UNIVERSITY OF AKRON (US) | 2017-08-24 | — | — | US | disclosed |
| WO-2006100591-A1 | 4-PIPERAZINNYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2006-09-28 | — | — | WO | disclosed |
| US-20060008442-A1 | Metal ion modified high surface area materials for odor removal and control | KIMBERLY-CLARK WORLDWIDE, INC. | 2006-01-12 | — | — | US | disclosed |
| WO-2005039657-A1 | HIGH SURFACE AREA MATERIAL BLENDS FOR ODOR REDUCTION, ARTICLES UTILIZING SUCH BLENDS AND METHODS OF USING SAME | KIMBERLY-CLARK WORLDWIDE, INC. (US) | 2005-05-06 | — | — | WO | disclosed |
| US-20050084632-A1 | High surface area material blends for odor reduction, articles utilizing such blends and methods of using same | KIMBERLY-CLARK WORLDWIDE, INC. | 2005-04-21 | — | — | US | disclosed |
| EP-1503853-A1 | METAL ION MODIFIED HIGH SURFACE AREA MATERIALS FOR ODOR REMOVAL AND CONTROL | Kimberly-Clark Worldwide, Inc. (US) | 2005-02-09 | — | — | EP | disclosed |
| US-20040077239-A1 | Zeolites bonded to a thermoplastic granulate by fusible bonds. | PAUL-HARTMANN AG (DE) | 2004-04-22 | — | — | US | disclosed |
| WO-2003092885-A1 | METAL ION MODIFIED HIGH SURFACE AREA MATERIALS FOR ODOR REMOVAL AND CONTROL | KIMBERLY-CLARK WORLDWIDE, INC. (US) | 2003-11-13 | — | — | WO | disclosed |
| US-20030203009-A1 | Metal ion modified high surface area materials for odor removal and control | KIMBERLY-CLARK WORLDWIDE, INC. | 2003-10-30 | — | — | US | disclosed |
| US-3989852-A | PRESERVATION | PALMER EDWIN | 1976-11-02 | — | — | US | disclosed |