Thioctic Acid Amide

Thioctic Acid Amide

SCHEMBL13093778

NC(=O)CCCC[C@H]1CCSS1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 1.00
TARDBP Q13148 2/20 1.00
HSD17B10 Q99714 2/20 0.74
CYP2C9 P11712 1/20 0.74
MEN1 O00255 1/20 0.74
NR1I2 O75469 1/20 0.74
ALDH1A1 P00352 1/20 0.74
LMNA P02545 1/20 0.74
POLB P06746 1/20 0.74
THRB P10828 1/20 0.74
TSHR P16473 1/20 0.74
ACHE P22303 1/20 0.74
APEX1 P27695 1/20 0.74
RECQL P46063 1/20 0.74
BLM P54132 1/20 0.74
PMP22 Q01453 1/20 0.74
TDP1 Q9NUW8 1/20 0.74
SAE1 Q9UBE0 1/20 0.74
UBA2 Q9UBT2 1/20 0.74
L3MBTL1 Q9Y468 1/20 0.74

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 Amide SCHEMBL4380181 1.00 KMT2A (1.00) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL50599 1.00 KMT2A (1.00) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL41833 1.00 KMT2A (1.00) KMT2ATARDBPHSD17B10CYP2C9MEN1
SCHEMBL27494633 0.98 KMT2A (0.96) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL28076123 0.98 KMT2A (0.96) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL16653981 0.98 KMT2A (0.96) KMT2ATARDBPHSD17B10CYP2C9MEN1
SCHEMBL29249630 0.98 KMT2A (0.96) KMT2ATARDBPHSD17B10CYP2C9MEN1
SCHEMBL7841850 0.94 KMT2A (0.89) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL3400641 0.93 KMT2A (0.87) KMT2ATARDBPHSD17B10CYP2C9MEN1
Thioctic Acid Amide SCHEMBL1895286 0.93 HSD17B10 (0.87) KMT2ATARDBPHSD17B10CYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150150770-A1 METHODS OF TREATING SKIN TRACIE MARTYN INTERNATIONAL INC (US) 2015-06-04 US disclosed
US-20150150770-A1 METHODS OF TREATING SKIN TRACIE MARTYN INTERNATIONAL INC (US) 2015-06-04 US disclosed
US-8933273-B2 Borate moiety-contained linker and bio-sensing element containing the same NATIONAL CHIAO TUNG UNIVERSITY (TW) 2015-01-13 US disclosed
US-20140155961-A1 METHODS OF TREATING SKIN Tracie Martyn International, Inc. (US) 2014-06-05 US disclosed
US-20140155961-A1 METHODS OF TREATING SKIN Tracie Martyn International, Inc. (US) 2014-06-05 US disclosed
US-20100272790-A1 Methods of Treating Skin TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-10-28 US disclosed
US-20100272790-A1 Methods of Treating Skin TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-10-28 US disclosed
US-7776915-B2 Topical formulations and methods of use TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-08-17 US disclosed
US-7776915-B2 Topical formulations and methods of use TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-08-17 US disclosed
CN-1208035-A Dithiolan derivatives, their preparation and their therapeutic effect SANKYO CO (JP) 1999-02-17 CN 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-20140155961-A1 METHODS OF TREATING SKIN CUTA, LIPA, DLAT KMT2A 2256/4885TARDBP 3891/4885HSD17B10 583/4885
US-20100272790-A1 Methods of Treating Skin CUTA, LIPA, DLAT KMT2A 2256/4885TARDBP 3891/4885HSD17B10 583/4885
US-20150150770-A1 METHODS OF TREATING SKIN CUTA, LIPA, DLAT KMT2A 2256/4885TARDBP 3891/4885HSD17B10 583/4885

“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.