SCHEMBL1426323

SCHEMBL1426323

Nc1ncnc2c1ncn2Cc1nc2ccccc2c(=O)n1-c1cc(Cl)ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.58
PIK3R1 P27986 3/20 0.58
PIK3CG P48736 2/20 0.58
PIK3CB P42338 1/20 0.58
ADORA2A P29274 2/20 0.49
PI4KA P42356 1/20 0.49
PI4K2B Q8TCG2 1/20 0.49
PI4K2A Q9BTU6 1/20 0.49
PI4KB Q9UBF8 1/20 0.49
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
P2RX7 Q99572 1/20 0.42
POLB P06746 1/20 0.41
RECQL P46063 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
SCHEMBL733947 0.90 PIK3CD (0.59) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL734302 0.83 PIK3CD (0.57) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL733295 0.83 PIK3CD (0.57) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL733067 0.82 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL733839 0.81 PIK3CD (0.75) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL27897291 0.81 PIK3CD (0.60) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL733231 0.80 PIK3CD (0.58) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL732730 0.79 PIK3CD (0.55) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL733199 0.79 PIK3CD (0.70) PIK3CDPIK3R1PIK3CGPIK3CBADORA2A
SCHEMBL734208 0.79 PIK3CD (0.88) PIK3CDPIK3R1PIK3CGPIK3CB

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-1278748-B1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORP (US) 2011-03-23 EP disclosed