SCHEMBL6178291

SCHEMBL6178291

CC(C)(C)CCCCCC(O)CCCCCC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.59
ACACA Q13085 1/20 0.59
FFAR1 O14842 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
GPR84 Q9NQS5 5/20 0.36
RIPK1 Q13546 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
NFKB1 P19838 1/20 0.33
TRPA1 O75762 1/20 0.33
FAAH O00519 1/20 0.32
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL22819360 1.00 ACACB (0.59) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL10264139 0.97 ACACB (0.56) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL14293914 0.92 ACACB (0.48) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL12092765 0.91 ACACB (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL8897109 0.91 FFAR1 (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL25479048 0.91 ACACB (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL8895607 0.91 FFAR1 (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL8897199 0.91 ACACB (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL8897706 0.91 ACACB (0.52) ACACBACACAFFAR1FFAR4GPR84
SCHEMBL30483471 0.91 ACACB (0.52) ACACBACACAFFAR1FFAR4GPR84

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735701-B Preparation method of 8-hydroxy-2,2,14,14-tetramethyl pentadecane diacid 新发药业有限公司 2023-09-08 CN claimed
CN-115504914-B Preparation method of bevacizidine acid intermediate 武汉武药科技有限公司 2024-05-07 CN disclosed
CN-117623923-A Synthesis method of bevacizidine acid intermediate compound 安徽艾立德制药有限公司 2024-03-01 CN disclosed
CN-117551009-A Synthesis method of bevacizidine acid intermediate 武汉武药科技有限公司 2024-02-13 CN disclosed
CN-116924886-A Synthesis method of 8-oxo-2,2,14,14-tetramethyl pentadecanedioic acid 武汉武药科技有限公司 2023-10-24 CN disclosed
CN-113735701-B Preparation method of 8-hydroxy-2,2,14,14-tetramethyl pentadecane diacid 新发药业有限公司 2023-09-08 CN disclosed
CN-113735701-B Preparation method of 8-hydroxy-2,2,14,14-tetramethyl pentadecane diacid 新发药业有限公司 2023-09-08 CN disclosed
CN-113735701-B Preparation method of 8-hydroxy-2,2,14,14-tetramethyl pentadecane diacid 新发药业有限公司 2023-09-08 CN disclosed
CN-116120163-A Synthesis method of bevacizidine acid and intermediate thereof 安徽艾立德制药有限公司 2023-05-16 CN disclosed
CN-109721486-A A kind of synthetic method of 8- hydroxyl -2,2,14,14- tetramethyl-pentacosandioic acid 鲁南制药集团股份有限公司 2019-05-07 CN disclosed
US-20170349516-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. 2017-12-07 US disclosed
US-9000041-B2 Hydroxyl compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS, INC. (US) 2015-04-07 US disclosed
US-20130289117-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2013-10-31 US disclosed
US-20130289117-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2013-10-31 US disclosed
US-20110003860-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. 2011-01-06 US disclosed
US-7335799-B2 Hydroxyl compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
EP-1597223-A2 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2005-11-23 EP disclosed
WO-2004067489-A2 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2004-08-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130289117-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES NR1H3, CYP27A1, NR1H2 ACACB 543/4885ACACA 495/4885FFAR1 205/4885
US-20170349516-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES NR1H3, CYP27A1, NR1H2 ACACB 543/4885ACACA 495/4885FFAR1 205/4885
US-20110003860-A1 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES NR1H3, CYP27A1, NR1H2 ACACB 543/4885ACACA 495/4885FFAR1 205/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.