SCHEMBL28053770

SCHEMBL28053770

CC(=O)c1ccc2c(c1)N(C=O)c1ccccc1S2

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 4/20 0.68
LMNA P02545 2/20 0.68
MAPT P10636 2/20 0.68
MAPK1 P28482 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
HTR1A P08908 3/20 0.54
DRD2 P14416 3/20 0.54
SLC6A2 P23975 3/20 0.54
SLC6A4 P31645 3/20 0.54
ADRA1A P35348 3/20 0.54
DRD3 P35462 3/20 0.54
SLC6A3 Q01959 3/20 0.54
KCNH2 Q12809 3/20 0.54
ADRA2A P08913 2/20 0.54
DRD1 P21728 2/20 0.54
CYP1A2 P05177 2/20 0.54
CHRM2 P08172 2/20 0.54
CYP2D6 P10635 2/20 0.54
CHRM1 P11229 2/20 0.54

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
SCHEMBL1983443 0.81 NOX1 (1.00) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL4622014 0.79 NOX1 (0.73) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL30725912 0.79 NOX1 (0.73) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL627990 0.79 MAOA (0.52) NOX1LMNAMEN1KMT2ABCHE
SCHEMBL27573856 0.77 LMNA (0.68) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL13938144 0.76 BCHE (0.54) LMNAMAPTMAPK1TDP1HTR1A
SCHEMBL10889466 0.75 CYP2D6 (0.50) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL9475738 0.75 HTR1A (0.77) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL9380936 0.75 HTR1A (0.74) NOX1LMNAMAPTMAPK1TDP1
SCHEMBL16492910 0.75 NOX1 (0.83) NOX1LMNAMAPTMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105367514-A Method for synthesizing 2-acetyl phenothiazine using phenothiazine as raw material TAICANG YUNTONG BIOCHEMICAL ENG CO LTD 2016-03-02 CN claimed
CN-105367514-A Method for synthesizing 2-acetyl phenothiazine using phenothiazine as raw material TAICANG YUNTONG BIOCHEMICAL ENG CO LTD 2016-03-02 CN disclosed