SCHEMBL10329462

SCHEMBL10329462

COC(=O)C(S)C(S)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
CA14 Q9ULX7 2/20 0.40
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 2/20 0.37
CA12 O43570 1/20 0.37
HSD17B10 Q99714 3/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ABCB11 O95342 1/20 0.37
F2 P00734 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN5 P54829 1/20 0.37
PTPN11 Q06124 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL7640960 1.00 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL29064781 0.88
SCHEMBL10329475 0.85 SMN1; SMN2 (0.44) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL2138019 0.85
SCHEMBL8313441 0.81 SMN1; SMN2 (0.34) SMN1; SMN2CA14ALDH1A1
SCHEMBL5755090 0.80
SCHEMBL2035273 0.80 SMN1; SMN2 (0.48) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL14574445 0.79 SMN1; SMN2 (0.39) SMN1; SMN2CA14ALDH1A1KMT2ACA12
SCHEMBL11574487 0.79 SMN1; SMN2 (0.37) SMN1; SMN2CA14KMT2ACA12
SCHEMBL932508 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104211679-B 1,3-dithiolane derivatives, synthesis, nano structure, activity, and application thereof as lead dispelling agent 首都医科大学 2017-05-24 CN claimed
CN-104211679-A 1,3-dithiolane derivatives, synthesis, nano structure, activity, and application thereof as lead dispelling agent UNIV CAPITAL MEDICAL SCIENCES 2014-12-17 CN claimed
CN-102241665-B 4-(4,5-dimethoxycarboxyl-1,3-dithiolane-2-yl)benzoyl-L-amino acid benzyl ester as well as synthesis method and applications thereof UNIV CAPITAL MEDICAL 2013-05-08 CN claimed
CN-102241665-A 4-(4,5-dimethoxycarboxyl-1,3-dithiolane-2-yl)benzoyl-L-amino acid benzyl ester as well as synthesis method and applications thereof UNIV CAPITAL MEDICAL 2011-11-16 CN claimed
US-20180161261-A1 METHOD FOR DECOLORIZING DYED KERATINIC FIBERS HENKEL AG & CO. KGAA (DE) 2018-06-14 US disclosed
CN-104211679-B 1,3-dithiolane derivatives, synthesis, nano structure, activity, and application thereof as lead dispelling agent 首都医科大学 2017-05-24 CN disclosed
CN-104211679-A 1,3-dithiolane derivatives, synthesis, nano structure, activity, and application thereof as lead dispelling agent UNIV CAPITAL MEDICAL SCIENCES 2014-12-17 CN disclosed
CN-102241665-B 4-(4,5-dimethoxycarboxyl-1,3-dithiolane-2-yl)benzoyl-L-amino acid benzyl ester as well as synthesis method and applications thereof UNIV CAPITAL MEDICAL 2013-05-08 CN disclosed
EP-2300518-B1 ANTIREFLECTIVE COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA (US) 2012-08-15 EP disclosed
US-8221965-B2 Antireflective coating compositions AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-07-17 US disclosed
US-8221965-B2 Antireflective coating compositions AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-07-17 US disclosed
CN-102241665-A 4-(4,5-dimethoxycarboxyl-1,3-dithiolane-2-yl)benzoyl-L-amino acid benzyl ester as well as synthesis method and applications thereof UNIV CAPITAL MEDICAL 2011-11-16 CN disclosed
US-20100009293-A1 Antireflective Coating Compositions MERCK PATENT GMBH (DE) 2010-01-14 US disclosed
US-20100009293-A1 Antireflective Coating Compositions MERCK PATENT GMBH (DE) 2010-01-14 US disclosed
WO-2010004377-A1 ANTIREFLECTIVE COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-01-14 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 (1 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-20180161261-A1 METHOD FOR DECOLORIZING DYED KERATINIC FIBERS KRT18, DUOX2, AOC1 SMN1; SMN2 4570/4885CA14 561/4885ALDH1A1 404/4885

“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.