Lipoic Acid, Alpha

Lipoic Acid, Alpha

SCHEMBL4898905

O=C(O)CCCCC1CCSS1.[NaH]

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.96
KMT2A Q03164 2/20 0.96
TARDBP Q13148 2/20 0.96
CYP2C9 P11712 1/20 0.96
MEN1 O00255 1/20 0.96
NR1I2 O75469 1/20 0.96
ALDH1A1 P00352 1/20 0.96
LMNA P02545 1/20 0.96
POLB P06746 1/20 0.96
THRB P10828 1/20 0.96
TSHR P16473 1/20 0.96
ACHE P22303 1/20 0.96
APEX1 P27695 1/20 0.96
RECQL P46063 1/20 0.96
BLM P54132 1/20 0.96
PMP22 Q01453 1/20 0.96
TDP1 Q9NUW8 1/20 0.96
SAE1 Q9UBE0 1/20 0.96
UBA2 Q9UBT2 1/20 0.96
L3MBTL1 Q9Y468 1/20 0.96

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
Thioctic Acid SCHEMBL4898896 1.00 HSD17B10 (0.96) HSD17B10KMT2ATARDBPCYP2C9MEN1
Lipoic Acid, Alpha SCHEMBL1981737 0.98 HSD17B10 (1.00) HSD17B10KMT2ATARDBPCYP2C9MEN1
Lipoic Acid, Alpha SCHEMBL2128472 0.98 HSD17B10 (1.00) HSD17B10KMT2ATARDBPCYP2C9MEN1
Lipoic Acid, Alpha SCHEMBL51065 0.98 HSD17B10 (1.00) HSD17B10KMT2ATARDBPCYP2C9MEN1
Thioctic Acid SCHEMBL4611014 0.98 HSD17B10 (1.00) HSD17B10KMT2ATARDBPCYP2C9MEN1
Thioctic Acid SCHEMBL7924 0.98 HSD17B10 (1.00) HSD17B10KMT2ATARDBPCYP2C9MEN1
SCHEMBL25257437 0.96 HSD17B10 (0.96) HSD17B10KMT2ATARDBPCYP2C9MEN1
Thioctic Acid SCHEMBL6037631 0.96 HSD17B10 (0.96) HSD17B10KMT2ATARDBPCYP2C9MEN1
Lipoic Acid, Alpha SCHEMBL6037633 0.96 HSD17B10 (0.96) HSD17B10KMT2ATARDBPCYP2C9MEN1
SCHEMBL7914749 0.96 HSD17B10 (0.96) HSD17B10KMT2ATARDBPCYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924347-A Preparation method of monosulfur organosilane coupling agent 江西宏柏新材料股份有限公司 2024-04-26 CN claimed
CN-117186142-A Process for preparing 3-octanoyl thiopropyl triethoxysilane 浙江开化合成材料有限公司 2023-12-08 CN claimed
US-20080234380-A1 Compositions and method for treatment of chronic inflammatory diseases SHAPIRO HOWARD K 2008-09-25 US claimed
US-20050090553-A1 Compositions and method for treatment of chronic inflammatory diseases SECANT PHARMA, LLC 2005-04-28 US claimed
CN-117924347-A Preparation method of monosulfur organosilane coupling agent 江西宏柏新材料股份有限公司 2024-04-26 CN disclosed
CN-117924347-A Preparation method of monosulfur organosilane coupling agent 江西宏柏新材料股份有限公司 2024-04-26 CN disclosed
CN-117186142-A Process for preparing 3-octanoyl thiopropyl triethoxysilane 浙江开化合成材料有限公司 2023-12-08 CN disclosed
CN-117186142-A Process for preparing 3-octanoyl thiopropyl triethoxysilane 浙江开化合成材料有限公司 2023-12-08 CN disclosed
CN-114682183-A Continuous flow production method of lipoic acid bulk drug 江苏同禾药业有限公司 2022-07-01 CN disclosed
CN-104387364-B L-ornithine lipoic acid composite salt and preparation method and application thereof 南京工业大学 2016-11-16 CN disclosed
CN-105001195-A New crystal form of R(+)-thioctic acid-L-lysinate and preparation method thereof NANJING HAIRONG PHARMACEUTICAL TECHNOLOGY CO LTD 2015-10-28 CN disclosed
CN-104387364-A L-ornithine lipoic acid composite salt and preparation method and application thereof NANJING UNIVERSITY OF TECHNOLOGY 2015-03-04 CN disclosed
CN-101607955-B Preparation method for low-residue lipoic acid SHANGHAI JINLI CHEMICAL CO LTD 2012-11-28 CN disclosed
CN-101607955-A A kind of preparation method of low-residue lipoic acid SHANGHAI JINLI CHEMICAL CO LTD (CN) 2009-12-23 CN disclosed
US-6348490-B1 RELEASING AND FORMING RACEMIC MIXTURES ASTA MEDICA AKTIENGESELLSCHAFT (DE) 2002-02-19 US disclosed
US-5990152-A ACID RESISTANT TO GASTRIC JUICE; RAPIDLY DISSOLVES IN THE DUODENUM; GROUP 1A AND 2A METAL SALTS; AMMONIUM AND AMINE SALTS; STORAGE STABILITY ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1999-11-23 US 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 (2 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-20050090553-A1 Compositions and method for treatment of chronic inflammatory diseases PCCA, HMGB1, PTGES HSD17B10 1039/4885KMT2A 1830/4885TARDBP 2554/4885
US-20080234380-A1 Compositions and method for treatment of chronic inflammatory diseases HMGB1, PCCA, QSOX1 HSD17B10 1124/4885KMT2A 1426/4885TARDBP 2637/4885

“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.