SCHEMBL6180156

SCHEMBL6180156

CC(C)OC(=O)[C@H](C)O

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL16370205 1.00
SCHEMBL141671 1.00
SCHEMBL30831878 1.00 TSHR (0.50)
Isopropyl Alcohol SCHEMBL1270303 0.97 TSHR (0.48)
Benzene SCHEMBL28364949 0.92 TSHR (0.43)
SCHEMBL29166713 0.92 TSHR (0.43)
SCHEMBL13317839 0.89 TSHR (0.42)
SCHEMBL13121943 0.89 TSHR (0.42)
SCHEMBL15307352 0.89 TSHR (0.42)
SCHEMBL6133109 0.85 ALDH1A1 (0.40)

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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1194054-C Printing ink containing water and its use FRANKTEIPP POSTHLIJA GMBH & CO (DE) 2005-03-23 CN claimed
EP-1072653-B1 Aqueous ink and its use FRANCOTYP POSTALIA AG (DE) 2005-03-02 EP claimed
US-6551391-B1 An aqueous ink containing a dyestuff, an alkanol having atleast one hydroxy group and stratight or branched carbon chain, an alkyl ester of alpha-hydroxycarboxylic acid as penetration agent and balance is water FRANCOTYP-POSTALIA AG & CO. (DE) 2003-04-22 US claimed
CN-1281877-A Printing ink containing water and its use FRANKTEIPP POSTHLIJA GMBH & CO (DE) 2001-01-31 CN claimed
US-20240298681-A1 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC. 2024-09-12 US disclosed
EP-3345484-B1 MEAT SUBSTITUTE AND METHOD FOR IMPARTING A BEEF-LIKE FLAVOUR TO A MEAT SUBSTITUTE IMPOSSIBLE FOODS INC (US) 2022-08-10 EP disclosed
CN-110283118-B Preparation method of barnidipine key intermediate 贵州医科大学 2022-05-17 CN disclosed
US-11224241-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-18 US disclosed
US-11219232-B2 Methods and compositions for affecting the flavor and aroma profile of consumables IMPOSSIBLE FOODS INC. (US) 2022-01-11 US disclosed
US-20210051976-A1 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC. 2021-02-25 US disclosed
US-20210037851-A1 METHODS AND COMPOSITIONS FOR AFFECTING THE FLAVOR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC. 2021-02-11 US disclosed
CN-108727187-B Preparation method of (R) - (+) -2-p-hydroxyphenoxypropionic acid 淮安国瑞化工有限公司 2020-04-24 CN disclosed
US-6551391-B1 An aqueous ink containing a dyestuff, an alkanol having atleast one hydroxy group and stratight or branched carbon chain, an alkyl ester of alpha-hydroxycarboxylic acid as penetration agent and balance is water FRANCOTYP-POSTALIA AG & CO. (DE) 2003-04-22 US disclosed
US-6495566-B2 POTENT ANTAGONISTS AT THE STRYCHNINE INSENSITIVE GLYCINE BINDING SITE ASSOCIATED WITH THE N-METHYLASPARTIC ACID RECEPTOR COMPLEX SMITHKLINE BEECHAM CORPORATION 2002-12-17 US disclosed
US-20020169186-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS DI FABIO ROMANO (IT) 2002-11-14 US disclosed
US-20020052391-A1 Tetrahydroquinoline derivatives as glycine antagonists DI FABIO ROMANO (IT) 2002-05-02 US disclosed
US-6362199-B1 CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-03-26 US disclosed
EP-1086093-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLAXO WELLCOME S.p.A. (IT) 2001-03-28 EP disclosed
CN-1281877-A Printing ink containing water and its use FRANKTEIPP POSTHLIJA GMBH & CO (DE) 2001-01-31 CN disclosed
WO-1999064411-A1 TETRAHYDROQUINOLINE DERIVATIVES AS GLYCINE ANTAGONISTS GLAXO WELLCOME SPA (IT) 1999-12-16 WO disclosed