SCHEMBL8096192

SCHEMBL8096192

Cc1csc(S(=O)(=O)C2(c3cc(N)nc(-c4ccc(NC(=O)NC(C)(C)CO)cc4)n3)CC2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.36
PIK3CA P42336 7/20 0.36
POLB P06746 2/20 0.35
MAPK1 P28482 1/20 0.34
JAK2 O60674 1/20 0.32
RAB9A P51151 1/20 0.31
MTOR P42345 2/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
PRKD3 O94806 1/20 0.31
CSF1R P07333 1/20 0.31
RET P07949 1/20 0.31
FGFR1 P11362 1/20 0.31
FLT1 P17948 1/20 0.31
RPS6KB1 P23443 1/20 0.31
AXL P30530 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
FLT3 P36888 1/20 0.31
IRAK1 P51617 1/20 0.31

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
SCHEMBL8093434 0.97 PIK3CD (0.35) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8090804 0.88 MTOR (0.37) PIK3CDPIK3CAPOLBRAB9AMTOR
SCHEMBL8089088 0.87 PIK3CA (0.40) PIK3CDPIK3CAMAPK1RAB9AMTOR
SCHEMBL8096194 0.86 KDM4E (0.39) PIK3CDPIK3CAPOLBJAK2RAB9A
SCHEMBL8098772 0.85 PIK3CD (0.39) PIK3CDPIK3CARAB9AMTORPIK3CG
SCHEMBL8090187 0.85 PIK3CD (0.42) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8096233 0.84 PIK3CD (0.40) PIK3CDPIK3CAPOLB
SCHEMBL8085149 0.84 PIK3CA (0.39) PIK3CDPIK3CAMAPK1RAB9AMTOR
SCHEMBL8096026 0.84 POLB (0.40) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8098248 0.84 PIK3CD (0.39) PIK3CDPIK3CAPOLB

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-2009007748-A2 TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA AB (SE) 2009-01-15 WO disclosed