SCHEMBL8093668

SCHEMBL8093668

CS(=O)(=O)Cc1cc(N)nc(-c2ccc(NC(=S)Nc3ccccc3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
ALDH1A1 P00352 6/20 0.45
PIK3CA P42336 4/20 0.44
MTOR P42345 3/20 0.44
PIK3CD O00329 3/20 0.44
PTPN7 P35236 1/20 0.44
KDR P35968 1/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
MAPT P10636 4/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL1755648 0.90 PIK3CA (0.55) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8205071 0.90 PIK3CA (0.54) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8086866 0.88 MAPT (0.44) ALDH1A1PIK3CAMTORPIK3CDMEN1
SCHEMBL8099679 0.88 PIK3CD (0.52) ALDH1A1PIK3CAMTORPIK3CDKMT2A
SCHEMBL11925797 0.83 PIK3CA (0.49) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL11926032 0.83 ALDH1A1 (0.46) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8215196 0.82 CA12 (0.49) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8205971 0.82 NPC1 (0.44) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8093349 0.81 PIK3CD (0.48) POLBALDH1A1PIK3CAMTORPIK3CD
SCHEMBL8101524 0.81 MEN1 (0.54) ALDH1A1PIK3CAMTORPIK3CDMEN1

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-2009007750-A1 MORPHOLINO PYRIMIDINE DERIVATIVES USED IN DISEASES LINKED TO MTOR KINASE AND/OR PI3K ASTRAZENECA AB (SE) 2009-01-15 WO disclosed