SCHEMBL15314780

SCHEMBL15314780

CC1CCC(N=NCc2ccn(Cc3ccccc3)c(=O)c2O)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 13/20 0.65
VEGFA P15692 11/20 0.65
CNR1 P21554 2/20 0.47
CNR2 P34972 2/20 0.47
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP2D6 P10635 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK14 Q16539 2/20 0.39
LMNA P02545 1/20 0.37

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
SCHEMBL272935 0.79 EGLN1 (1.00) EGLN1VEGFACNR1CNR2HTT
SCHEMBL15255387 0.75 EGLN1 (0.70) EGLN1VEGFACNR1CNR2HTT
SCHEMBL14900099 0.75 EGLN1 (0.69) EGLN1VEGFAHTTKDM4ETP53
SCHEMBL15314777 0.74 CNR2 (0.42) EGLN1VEGFACNR1CNR2KDM4E
SCHEMBL17340665 0.73 EGLN1 (0.53) EGLN1VEGFACNR2HTTKDM4E
SCHEMBL12598814 0.71 EGLN1 (0.68) EGLN1VEGFAHTTKDM4ETP53
SCHEMBL278202 0.71 VEGFA (1.00) EGLN1VEGFAHTTKDM4ETP53
SCHEMBL12598863 0.71 EGLN1 (0.63) EGLN1VEGFAHTTKDM4ETP53
SCHEMBL273037 0.70 EGLN1 (0.87) EGLN1VEGFAHTTKDM4ETP53
SCHEMBL272116 0.69 VEGFA (0.85) EGLN1VEGFAHTTKDM4ETP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2952192-A1 Prolyl hydroxylase inhibitors Aerpio Therapeutics Inc. (US) 2015-12-09 EP disclosed
EP-2649998-B1 Prolyl hydroxylase inhibitors AERPIO THERAPEUTICS INC (US) 2015-03-04 EP disclosed
EP-2649998-A1 Prolyl hydroxylase inhibitors Aerpio Therapeutics Inc. (US) 2013-10-16 EP disclosed