SCHEMBL16857737

SCHEMBL16857737

COc1ccc(-c2ccc3nc(-n4cc(OC(=O)O)cn4)[nH]c(=O)c3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.53
ROCK2 O75116 3/20 0.43
ROCK1 Q13464 3/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MMP13 P45452 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL16857699 0.92 EGLN1 (0.56) EGLN1KDM4ELMNAHSD17B10
SCHEMBL16857755 0.91 EGLN1 (0.52) EGLN1ROCK2MMP13
SCHEMBL16857726 0.91 EGLN1 (0.56) EGLN1
SCHEMBL16857786 0.91 EGLN1 (0.57) EGLN1MMP13
SCHEMBL16857740 0.90 EGLN1 (0.50) EGLN1KDM4ELMNAHSD17B10
SCHEMBL16857773 0.89 EGLN1 (0.56) EGLN1MMP13
SCHEMBL16857897 0.89 EGLN1 (0.51) EGLN1ROCK2
SCHEMBL16857825 0.89 EGLN1 (0.51) EGLN1ROCK2ROCK1
SCHEMBL3030163 0.88 EGLN1 (0.69) EGLN1
SCHEMBL16857778 0.87 EGLN1 (0.53) EGLN1KDM4ELMNAHSD17B10MMP13

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