SCHEMBL2773872

SCHEMBL2773872

CCOC(=O)c1ccc(N(Cc2cncnc2)S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
TP53 P04637 1/20 0.51
PTGES O14684 5/20 0.49
ALOX5 P09917 3/20 0.49
KMT2A Q03164 2/20 0.49
NR1I2 O75469 1/20 0.49
RAB9A P51151 2/20 0.48
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
MAPT P10636 1/20 0.47
GRM2 Q14416 1/20 0.47
NR3C1 P04150 1/20 0.46
NPC1 O15118 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
SCHEMBL13064477 0.89 POLB (0.65) POLBL3MBTL1TP53PTGESALOX5
SCHEMBL2774660 0.85 PTGES (0.65) PTGESALOX5KMT2ANR1I2KDM4E
SCHEMBL13064400 0.83 POLB (0.59) POLBTP53PTGESALOX5KMT2A
SCHEMBL2776393 0.83 TP53 (0.72) POLBTP53PTGESALOX5KMT2A
SCHEMBL25412633 0.76 ALDH1A1 (0.63) POLBL3MBTL1TP53KMT2ANR1I2
SCHEMBL3275261 0.74 PTGES (0.59) L3MBTL1PTGESALOX5NR1I2RAB9A
SCHEMBL3641266 0.73 GRM2 (0.65) PTGESALOX5NR1I2RAB9AGRM2
SCHEMBL13065008 0.72 TP53 (0.62) POLBL3MBTL1TP53KMT2ACNR1
SCHEMBL16587180 0.72 TRPM8 (0.77)
SCHEMBL3278663 0.72 PTGES (0.84) PTGESALOX5KMT2ANR1I2KDM4E

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-2010130638-A1 SULFONAMIDE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF EVOTEC AG (DE) 2010-11-18 WO disclosed