SCHEMBL7082541

SCHEMBL7082541

NS(=O)(=O)c1cnc2sccn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.46
LIMK1 P53667 1/20 0.46
DYRK1A Q13627 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
KDM4E B2RXH2 9/20 0.45
HSD17B10 Q99714 9/20 0.39
ALDH1A1 P00352 8/20 0.39
HPGD P15428 6/20 0.39
RECQL P46063 1/20 0.39
MAPT P10636 6/20 0.38
TDP1 Q9NUW8 1/20 0.38
TNF P01375 1/20 0.35
NPC1 O15118 6/20 0.35
RAB9A P51151 6/20 0.35
TSHR P16473 3/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
GLA P06280 1/20 0.35
AHR P35869 1/20 0.35
PKM P14618 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
SCHEMBL1312160 0.82 CHEK1 (0.46) CHEK1LIMK1DYRK1ACLK4KDM4E
SCHEMBL5045177 0.71
SCHEMBL14976996 0.69 CHEK1 (0.51) CHEK1LIMK1DYRK1ACLK4KDM4E
SCHEMBL30746925 0.69 CHEK1 (0.60) CHEK1LIMK1DYRK1ACLK4KDM4E
SCHEMBL22616303 0.67
SCHEMBL15401844 0.67
SCHEMBL269609 0.67 CHEK1 (0.62) CHEK1LIMK1DYRK1ACLK4KDM4E
SCHEMBL7331691 0.67 CHEK1 (0.49) CHEK1LIMK1DYRK1ACLK4KDM4E
SCHEMBL1743494 0.66 MET (0.51) DYRK1AMET
SCHEMBL11403967 0.66 CHEK1 (0.73) CHEK1LIMK1DYRK1ACLK4KDM4E

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
WO-2003070244-A1 ANTAGONIST OF MELANIN CONCENTRATING HORMONE AND THEIR USES ABBOTT LABORATORIES (US) 2003-08-28 WO claimed
WO-2003070244-A1 ANTAGONIST OF MELANIN CONCENTRATING HORMONE AND THEIR USES ABBOTT LABORATORIES (US) 2003-08-28 WO disclosed