SCHEMBL10202045

SCHEMBL10202045

CC(Nc1ncnc(N)c1N)c1cnc2c(Cl)cc(F)cc2c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.46
PIK3CG P48736 13/20 0.46
PIK3CB P42338 9/20 0.46
PIK3CA P42336 8/20 0.46
BCL2 P10415 1/20 0.45
PIK3R2 O00459 4/20 0.43
CYP3A4 P08684 4/20 0.42
EGFR P00533 1/20 0.42
PIK3R1 P27986 1/20 0.41

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
SCHEMBL4092153 0.90 PIK3CD (0.49) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL4086456 0.90 PIK3CD (0.49) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL2718441 0.89 PIK3CD (0.60) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL4101416 0.84 BCL2 (0.54) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL4097654 0.82 PIK3CD (0.43) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL10202042 0.82 PIK3CD (0.43) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL4099701 0.82 PIK3CD (0.43) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL4097964 0.80 PIK3CD (0.47) PIK3CDPIK3CGPIK3CBPIK3CAPIK3R1
SCHEMBL15437009 0.79 PIK3CD (0.63) PIK3CDPIK3CGPIK3CBPIK3CABCL2
SCHEMBL2720230 0.79 PIK3CD (0.63) PIK3CDPIK3CGPIK3CBPIK3CABCL2

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-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 WO disclosed