SCHEMBL14944477

SCHEMBL14944477

CCN(CC)c1ccc(N=Nc2cc(Cl)c(F)cc2Cl)c(NS(C)(=O)=O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
GAA P10253 3/20 0.34
MAPT P10636 4/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 1/20 0.33
GLA P06280 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
NR3C1 P04150 3/20 0.32
NR3C2 P08235 2/20 0.32
PGR P06401 1/20 0.32
AR P10275 1/20 0.32
POLB P06746 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
SCHEMBL14945025 0.87 MAPT (0.33) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL14944478 0.76 MAPT (0.43) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL22476575 0.76 MAPT (0.38) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL11059570 0.75 NR3C1 (0.38) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL10827925 0.75 KDM4E (0.41) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL11169050 0.73 MAPT (0.44) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL31173922 0.73 MAPT (0.38) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL8898945 0.73 MAPT (0.38) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL8898950 0.73 MAPT (0.38) KDM4EGAAMAPTALDH1A1MEN1
SCHEMBL26418233 0.70 MAPT (0.48) KDM4EGAAMAPTALDH1A1L3MBTL1

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
US-8506652-B2 Disperse dyes COLOURTEX INDUSTRIES LIMITED (IN) 2013-08-13 US disclosed
US-20130117947-A1 DISPERSE DYES COLOURTEX INDUSTRIES LIMITED (IN) 2013-05-16 US disclosed