SCHEMBL11818111

SCHEMBL11818111

O=C(N=C=S)c1cccc2c1Nc1cc(C(F)(F)F)ccc1S2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 3/20 0.50
▸ CYBB P04839 2/20 0.50
▸ NOX3 Q9HBY0 2/20 0.50
▸ NOX4 Q9NPH5 2/20 0.50
▸ MAPT P10636 5/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ JUN P05412 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ AR P10275 1/20 0.37
▸ GAA P10253 5/20 0.33
▸ USP2 O75604 1/20 0.33
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ TP53 P04637 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33

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
Flutiazin SCHEMBL11818117 0.83 NOX1 (0.51) NOX1CYBBNOX3NOX4MAPT
Flutiazin SCHEMBL29394002 0.83 NOX1 (0.58) NOX1CYBBNOX3NOX4MAPT
Flutiazin SCHEMBL193601 0.83 NOX1 (0.58) NOX1CYBBNOX3NOX4MAPT
SCHEMBL11811857 0.82 NOX1 (0.57) NOX1CYBBNOX3NOX4MAPT
Flutiazin SCHEMBL11811863 0.82 NOX1 (0.57) NOX1CYBBNOX3NOX4MAPT
SCHEMBL11823962 0.74 NOX1 (0.49) NOX1CYBBNOX3NOX4MAPT
SCHEMBL1855582 0.70 NOX1 (0.83) NOX1CYBBNOX3NOX4MAPT
SCHEMBL560225 0.68 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT
SCHEMBL29475150 0.68 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT
Phenothiazine SCHEMBL6532335 0.68 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3962438-A Anti-arthritic 1H-pyrimido-(5,4,3-kl)phenothiazine-1,3(2H)-diones and 1-thiones SMITHKLINE CORPORATION (US) 1976-06-08 — — US disclosed
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