SCHEMBL13064477

SCHEMBL13064477

CCOC(=O)c1ccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.65
TP53 P04637 1/20 0.63
PTGES O14684 6/20 0.60
ALOX5 P09917 3/20 0.60
NR3C1 P04150 2/20 0.59
NR1I2 O75469 1/20 0.58
KMT2A Q03164 1/20 0.57
CNR1 P21554 1/20 0.57
CNR2 P34972 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MAPT P10636 3/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
KDM4E B2RXH2 1/20 0.56
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL2776393 0.92 TP53 (0.72) POLBTP53PTGESALOX5NR3C1
SCHEMBL13064400 0.92 POLB (0.59) POLBTP53PTGESALOX5NR3C1
SCHEMBL2773872 0.89 POLB (0.53) POLBTP53PTGESALOX5NR3C1
SCHEMBL3275261 0.84 PTGES (0.59) PTGESALOX5NR3C1NR1I2L3MBTL1
SCHEMBL3278663 0.83 PTGES (0.84) PTGESALOX5NR3C1NR1I2KMT2A
SCHEMBL25412633 0.82 ALDH1A1 (0.63) POLBTP53NR1I2KMT2AL3MBTL1
SCHEMBL13065008 0.80 TP53 (0.62) POLBTP53KMT2ACNR1CNR2
SCHEMBL1169287 0.80 LMNA (0.73) PTGESALOX5NR3C1KMT2ACNR1
SCHEMBL13064474 0.78 KMT2A (0.63) POLBKMT2AALDH1A1LMNANPSR1
SCHEMBL5330652 0.78 ESR1 (0.78) PTGESALOX5NR3C1NR1I2KMT2A

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