SCHEMBL16857723

SCHEMBL16857723

CC(C)(C)c1ccc2c(=O)[nH]c(-n3cc(OC(=O)O)cn3)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 11/20 0.42
MGLL Q99685 5/20 0.41
EGLN3 Q9H6Z9 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
SPR P35270 2/20 0.36

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
SCHEMBL16857753 0.93 EGLN1 (0.47) EGLN1MGLLEGLN3TNKSTNKS2
SCHEMBL16857833 0.90 EGLN1 (0.51) EGLN1MGLL
SCHEMBL16857845 0.86 EGLN1 (0.46) EGLN1MGLLEGLN3KDM4CSPR
SCHEMBL16857778 0.85 EGLN1 (0.53) EGLN1MGLL
SCHEMBL16857896 0.85 EGLN1 (0.43) EGLN1EGLN3KDM4C
SCHEMBL16857919 0.84 EGLN1 (0.48) EGLN1EGLN3
SCHEMBL16857827 0.84 EGLN1 (0.48) EGLN1MGLLKDM4CSPR
SCHEMBL16857744 0.84 EGLN1 (0.48) EGLN1MGLLEGLN3KDM4C
SCHEMBL3026665 0.84 EGLN1 (0.58) EGLN1
SCHEMBL16857898 0.84 EGLN1 (0.42) EGLN1MGLLEGLN3KDM4C

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
EP-2396316-B1 QUINAZOLINONES AS PROLYL HYDROXYLASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-07-01 EP claimed