SCHEMBL16857796

SCHEMBL16857796

CC(C)Oc1ccc2c(=O)[nH]c(-n3cc(OC(=O)O)cn3)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 15/20 0.42
MGLL Q99685 2/20 0.42
PARP15 Q460N3 1/20 0.38
PARP10 Q53GL7 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
EGLN3 Q9H6Z9 2/20 0.36
PDE9A O76083 1/20 0.36
KDM4C Q9H3R0 1/20 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
SCHEMBL16857869 0.93 EGLN1 (0.47) EGLN1MGLLPARP15PARP10TNKS2
SCHEMBL16857778 0.90 EGLN1 (0.53) EGLN1MGLL
SCHEMBL16857843 0.88 EGLN1 (0.42) EGLN1MGLLEGLN3KDM4C
SCHEMBL16857905 0.87 MGLL (0.42) EGLN1MGLLPARP15PARP10TNKS2
SCHEMBL3031462 0.87 EGLN1 (0.57) EGLN1EGLN3
SCHEMBL16857845 0.86 EGLN1 (0.46) EGLN1MGLLEGLN3KDM4C
SCHEMBL16857788 0.86 MGLL (0.46) EGLN1MGLLKDM4C
SCHEMBL16857896 0.85 EGLN1 (0.43) EGLN1EGLN3KDM4C
SCHEMBL16857868 0.85 EGLN1 (0.55) EGLN1MGLL
SCHEMBL16857919 0.84 EGLN1 (0.48) EGLN1EGLN3

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