SCHEMBL18175029

SCHEMBL18175029

CCN(CC)Cc1nc(S(=O)(=O)Nc2nc3ccccc3nc2N(C)c2cc(OC)cc(OC)c2OCCCO)cn1C

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 19/20 0.52
PIK3CD O00329 1/20 0.39

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
SCHEMBL4286767 0.87 PIK3CG (0.63) PIK3CGPIK3CD
SCHEMBL18175016 0.81 PIK3CG (0.48) PIK3CGPIK3CD
SCHEMBL4289262 0.81 PIK3CG (0.58) PIK3CGPIK3CD
SCHEMBL10044516 0.81 PIK3CG (0.73) PIK3CGPIK3CD
SCHEMBL4298874 0.79 PIK3CG (0.72) PIK3CGPIK3CD
SCHEMBL4302931 0.78 PIK3CG (0.53) PIK3CGPIK3CD
SCHEMBL4288599 0.75 PIK3CG (0.67) PIK3CGPIK3CD
SCHEMBL2732907 0.72 PIK3CG (0.70) PIK3CGPIK3CD
SCHEMBL2722455 0.72 PIK3CG (0.75) PIK3CGPIK3CD
SCHEMBL4291889 0.72 PIK3CG (0.62) PIK3CGPIK3CD

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 disclosed