SCHEMBL5797968

SCHEMBL5797968

CCOC(=O)Cc1cccc(NS(=O)(=O)c2ccc3ccccc3c2)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.68
MEN1 O00255 6/20 0.68
ALDH1A1 P00352 5/20 0.68
HSD11B1 P28845 2/20 0.60
GAA P10253 2/20 0.54
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
PKM P14618 1/20 0.48
HIF1A Q16665 1/20 0.47
MAPT P10636 1/20 0.46
KAT6A Q92794 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45

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
SCHEMBL5798138 0.87 ALDH1A1 (0.53) KMT2AMEN1ALDH1A1HSD11B1CYP2C9
SCHEMBL5794528 0.86 PKM (0.53) KMT2AMEN1ALDH1A1HSD11B1GAA
SCHEMBL5796067 0.84 HSD11B1 (0.61) KMT2AMEN1ALDH1A1HSD11B1GAA
SCHEMBL5811010 0.82 KMT2A (0.61) KMT2AMEN1ALDH1A1HSD11B1CYP2C9
SCHEMBL5806893 0.80 CDK5 (0.49) KMT2AMEN1ALDH1A1HSD11B1CYP2C9
SCHEMBL5794952 0.78 HSD11B1 (0.53) KMT2AMEN1ALDH1A1HSD11B1GAA
SCHEMBL5693072 0.76 HSD11B1 (0.76) KMT2AMEN1ALDH1A1HSD11B1CYP2C9
SCHEMBL9927453 0.76 HSD11B1 (1.00) KMT2AMEN1ALDH1A1HSD11B1PKM
SCHEMBL10420167 0.75 GAA (0.65) KMT2AMEN1ALDH1A1GAAPKM
SCHEMBL21381652 0.75 CTPS1 (0.57) KMT2AMEN1ALDH1A1HSD11B1CYP2C9

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-2006050908-A1 INHIBITORS OF 11ΒΕΤΑ-HYDROXY STEROID DEHYDROGENASE TYPE 1 (11BETA-HSD1) EVOTEC AG (DE) 2006-05-18 WO disclosed