SCHEMBL5338733

SCHEMBL5338733

CNC(=O)c1ccc2c(n1)NC(=O)CO2

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.44
MGLL Q99685 1/20 0.41
GAA P10253 1/20 0.40
NR3C1 P04150 1/20 0.39
SYK P43405 1/20 0.39
MMP12 P39900 1/20 0.39

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
SCHEMBL619718 0.82 NR3C2 (0.44) NR3C2MGLLGAANR3C1MMP12
SCHEMBL21972598 0.78 ALDH1A1 (0.44)
SCHEMBL21972597 0.75 MGLL (0.46) NR3C2MGLLSYK
SCHEMBL19250511 0.75 NR3C2 (0.44) NR3C2NR3C1SYKMMP12
SCHEMBL2489889 0.74 NR3C2 (0.50) NR3C2NR3C1MMP12
SCHEMBL21400918 0.73 NR3C2 (0.42) NR3C2GAANR3C1SYKMMP12
SCHEMBL21972595 0.73 ALDH1A1 (0.46) MGLL
SCHEMBL7980639 0.73 SYK (0.44) NR3C2NR3C1SYKMMP12
SCHEMBL19629922 0.72 NR3C2 (0.41) NR3C2MGLLGAANR3C1MMP12
SCHEMBL14611166 0.72 PDE3B (0.42)

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-2007016610-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-02-08 WO disclosed