SCHEMBL9007315

SCHEMBL9007315

FC(F)(F)c1ccc2c(c1)Sc1ccccc1NC2=S

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 7/20 0.66
CYBB P04839 1/20 0.66
NOX3 Q9HBY0 1/20 0.66
NOX4 Q9NPH5 1/20 0.66
ALDH1A1 P00352 2/20 0.64
MAPT P10636 7/20 0.48
GAA P10253 4/20 0.48
USP2 O75604 1/20 0.48
ALOX15 P16050 3/20 0.46
CYP1A2 P05177 2/20 0.46
BCHE P06276 2/20 0.46
ACHE P22303 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
ALOX12 P18054 1/20 0.46
MAOA P21397 1/20 0.46

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
SCHEMBL9007359 0.87 NOX1 (0.68) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL8879904 0.82 NOX1 (0.66) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL10372692 0.81 NOX1 (0.84) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL30811565 0.81 NOX1 (0.84) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL560225 0.80 NOX1 (1.00) NOX1CYBBNOX3NOX4ALDH1A1
Phenothiazine SCHEMBL6532335 0.80 NOX1 (1.00) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL29475150 0.80 NOX1 (1.00) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL7970097 0.79 ALDH1A1 (1.00) NOX1CYBBNOX3NOX4ALDH1A1
Benzene SCHEMBL29242186 0.78 NOX1 (0.97) NOX1CYBBNOX3NOX4ALDH1A1
SCHEMBL11880410 0.73 NOX1 (0.49) NOX1CYBBNOX3NOX4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5589474-A Dibenzothiazepinthione as antiviral agents GLAXO WELLCOME INC. (US) 1996-12-31 US disclosed
EP-0583317-A1 DIBENZOTHIAZEPINTHIONE AS ANTIVIRAL AGENTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-02-23 EP disclosed
WO-1992019607-A1 DIBENZOTHIAZEPINTHIONE AS ANTIVIRAL AGENTS THE WELLCOME FOUNDATION LIMITED (GB) 1992-11-12 WO disclosed