SCHEMBL30453755

SCHEMBL30453755

COC(=O)CNC(=O)c1ncc(-c2cn(-c3ccc(F)cc3)nn2)c(C)c1O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 12/20 0.49
VEGFA P15692 3/20 0.40
FLT1 P17948 3/20 0.40
EGLN3 Q9H6Z9 3/20 0.40
MIF P14174 4/20 0.40
GRM5 P41594 1/20 0.37
GRM1 Q13255 1/20 0.37
S1PR1 P21453 1/20 0.37
FLT3 P36888 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 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
SCHEMBL24257796 0.93 EGLN1 (0.47) EGLN1MIFGRM5GRM1S1PR1
SCHEMBL24257559 0.91 EGLN1 (0.59) EGLN1MIF
SCHEMBL24257715 0.83 EGLN1 (0.53) EGLN1
SCHEMBL24257555 0.82 EGLN1 (0.66) EGLN1
SCHEMBL24257767 0.77 NPC1 (0.41) EGLN1VEGFAFLT1EGLN3
SCHEMBL24257606 0.76 EGLN1 (0.48) EGLN1VEGFAFLT1EGLN3
SCHEMBL24257842 0.75 EGLN1 (0.52) EGLN1VEGFAFLT1EGLN3
SCHEMBL24257554 0.74 EGLN1 (0.48) EGLN1VEGFAFLT1EGLN3
SCHEMBL24257716 0.71 EGLN1 (0.58) EGLN1VEGFAFLT1EGLN3
SCHEMBL30546836 0.71 EGLN1 (0.58) EGLN1VEGFAFLT1EGLN3

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-4196466-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE Akebia Therapeutics Inc. (US) 2023-06-21 EP disclosed