SCHEMBL17857346

SCHEMBL17857346

Cc1nc2c(C(=O)O)cc(N3CCOCC3)nn2c1Cc1cccc(CF)c1C

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.83
PIK3CG P48736 16/20 0.83
MTOR P42345 15/20 0.83
PIK3C2B O00750 19/20 0.81
PIK3CB P42338 5/20 0.80
PIK3CA P42336 4/20 0.80

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
SCHEMBL17857391 0.91 PIK3CD (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857098 0.91 PIK3CD (0.69) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857264 0.89 PIK3C2B (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857384 0.89 PIK3CD (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857023 0.81 PIK3CD (0.82) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857347 0.81 PIK3CD (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857396 0.81 PIK3C2B (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857093 0.80 PIK3CD (0.82) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL17857356 0.80 PIK3CD (1.00) PIK3CDPIK3CGMTORPIK3C2BPIK3CB
SCHEMBL19760567 0.80 PIK3CD (0.83) PIK3CDPIK3CGMTORPIK3C2BPIK3CB

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-2016097347-A1 IMIDAZOPYRIDAZINE DERIVATIVES AS ΡΙ3Κβ INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-06-23 WO disclosed