SCHEMBL17695671

SCHEMBL17695671

OCc1cccc(-c2noc(CSc3nnc(-c4cnccn4)o3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TERT O14746 4/20 0.56
GSK3A P49840 1/20 0.54
GSK3B P49841 1/20 0.54
PIEZO1 Q92508 12/20 0.51
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL17695680 0.89 GSK3B (0.56) TERTGSK3AGSK3BHSD17B10ALDH1A1
SCHEMBL17695691 0.86 GSK3A (0.71) TERTGSK3AGSK3BPIEZO1HSD17B10
SCHEMBL17695696 0.86 GSK3A (0.61) TERTGSK3AGSK3BPIEZO1HSD17B10
SCHEMBL17695693 0.83 GSK3A (0.69) TERTGSK3AGSK3BPIEZO1HSD17B10
SCHEMBL17695699 0.82 TERT (0.58) TERTGSK3AGSK3BPIEZO1HSD17B10
SCHEMBL17695687 0.78 GSK3B (0.69) TERTGSK3AGSK3BPIEZO1HSD17B10
SCHEMBL17695697 0.77 GSK3A (0.62) TERTGSK3AGSK3BHSD17B10ALDH1A1
SCHEMBL17695679 0.75 GSK3A (0.72) GSK3AGSK3BHSD17B10MEN1ALDH1A1
SCHEMBL17695702 0.75 GSK3A (0.71) GSK3AGSK3BHSD17B10ALDH1A1
SCHEMBL17695676 0.74 GSK3B (0.66) GSK3AGSK3BALDH1A1MAPT

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
WO-2016061344-A1 GSK3 INHIBITORS AND THEIR USES MIRX PHARMACEUTICALS LLC (US) 2016-04-21 WO disclosed