SCHEMBL18167162

SCHEMBL18167162

COc1cc(Nc2nc3ccccc3nc2C(N)=O)c(OCCCCO)c(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 16/20 0.44
RAD52 P43351 2/20 0.40
BRD4 O60885 1/20 0.40
MAPT P10636 1/20 0.38

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
SCHEMBL18167163 0.97 PIK3CG (0.44) PIK3CGRAD52BRD4MAPT
SCHEMBL18167157 0.95 PIK3CG (0.46) PIK3CGRAD52BRD4MAPT
SCHEMBL15192968 0.92 PIK3CG (0.42) PIK3CGRAD52BRD4MAPT
SCHEMBL15192666 0.88 PIK3CG (0.43) PIK3CGMAPT
SCHEMBL16241816 0.88 PIK3CG (0.40) PIK3CGBRD4MAPT
SCHEMBL15193666 0.88 MAPT (0.39) PIK3CGBRD4MAPT
SCHEMBL18167149 0.87 PIK3CG (0.38) PIK3CGBRD4MAPT
SCHEMBL18167159 0.87 PIK3CG (0.46) PIK3CGMAPT
SCHEMBL18167151 0.87 PIK3CG (0.38) PIK3CGBRD4MAPT
SCHEMBL15192985 0.87 MAPT (0.46) PIK3CGMAPT

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-2630129-B1 QUINOXALINE DERIVATES MERCK PATENT GMBH (DE) 2016-10-26 EP claimed