SCHEMBL8712895

SCHEMBL8712895

Cc1ccc(S(=O)(=O)c2cccc3[nH]c(S)nc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
EGFR P00533 1/20 0.40
SRC P12931 1/20 0.40
COMT P21964 5/20 0.39
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPY1R P25929 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
MAPT P10636 1/20 0.36
HTR6 P50406 1/20 0.35

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
SCHEMBL8327247 0.86 PARP1 (0.46) FEN1GAAKDM4EALDH1A1EGFR
SCHEMBL8331002 0.80 GAA (0.43) FEN1GAAKDM4EALDH1A1EGFR
SCHEMBL8034262 0.79 PTGS1 (0.37) GAAKDM4EKMT2AMAPT
SCHEMBL11327139 0.78 DUSP5 (0.35) KDM4E
Silver SCHEMBL9320049 0.78 PARP1 (0.33) KDM4E
SCHEMBL989259 0.76 L3MBTL1 (0.40) KDM4ECOMT
SCHEMBL8327401 0.75 GAA (0.39) FEN1GAAKDM4EALDH1A1EGFR
SCHEMBL8327356 0.74 GAA (0.38) FEN1GAAKDM4EALDH1A1EGFR
SCHEMBL8324966 0.71 CACNA1G (0.39) FEN1GAAALDH1A1COMTMEN1
SCHEMBL8328463 0.71 SMN1; SMN2 (0.35) FEN1GAAKDM4EALDH1A1EGFR

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
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed