Dihydrolipoic Acid

Dihydrolipoic Acid

SCHEMBL2582100

O=C([O-])CCCCC(S)CCS.O=C([O-])CCCCC(S)CCS.[Zn+2]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.39
CA1 P00915 3/20 0.35
GSTK1 Q9Y2Q3 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
ENPEP Q07075 1/20 0.33
BBOX1 O75936 1/20 0.33
FABP3 P05413 5/20 0.32
FOLH1 Q04609 2/20 0.32
CA2 P00918 1/20 0.32

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
Dihydrolipoic Acid SCHEMBL4761909 0.98 NFKB1 (0.38) NFKB1CA1GSTK1GPR84ENPEP
Dihydrolipoic Acid SCHEMBL1659440 0.96 NFKB1 (0.39) NFKB1CA1GSTK1GPR84ENPEP
Dihydrolipoic Acid SCHEMBL718014 0.96 NFKB1 (0.43) NFKB1CA1GSTK1GPR84ENPEP
Dihydrolipoic Acid SCHEMBL5827361 0.96 NFKB1 (0.39) NFKB1CA1GSTK1GPR84ENPEP
Dihydrolipoic Acid SCHEMBL4094129 0.89 GSTK1 (0.46) NFKB1GSTK1ENPEPFOLH1
Zinc Ion SCHEMBL3337795 0.86 HDAC3 (0.36) NFKB1
Zinc Ion SCHEMBL3337707 0.84 HDAC3 (0.41)
Zinc Ion SCHEMBL2580314 0.84 HDAC3 (0.35) NFKB1
Zinc Ion SCHEMBL2583379 0.83 HDAC3 (0.40)
SCHEMBL3276879 0.82 HDAC3 (0.36) NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122100-A1 Melanin extinguisher OGA RESEARCH, INCORPORATED (JP) 2006-06-08 US claimed
EP-1547590-A1 MELANIN EXTINGUISHER Oga Research, Incorporated (JP) 2005-06-29 EP claimed
US-8048911-B2 Melanin eliminator preparation OGA Research, Inc. (JP) 2011-11-01 US disclosed
US-20090093541-A1 MELANIN ELIMINATOR PREPARATION OGA RESEARCH, INC (JP) 2009-04-09 US disclosed
JP-2006206561-A STABILIZATION OF LIPOIC ACID DERIVATIVE-CONTAINING AQUEOUS PREPARATION IWAKI KK 2006-08-10 JP disclosed
US-20060122100-A1 Melanin extinguisher OGA RESEARCH, INCORPORATED (JP) 2006-06-08 US disclosed
EP-1547590-A1 MELANIN EXTINGUISHER Oga Research, Incorporated (JP) 2005-06-29 EP 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-20060122100-A1 Melanin extinguisher TYR, MC1R, MITF NFKB1 2770/4885CA1 4152/4885GSTK1 2911/4885
US-20090093541-A1 MELANIN ELIMINATOR PREPARATION TYR, MC1R, MCHR1 NFKB1 4004/4885CA1 4071/4885GSTK1 3045/4885

“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.