SCHEMBL30670789

SCHEMBL30670789

O=c1c(-c2cccc(F)c2)c(CNc2ncnc3[nH]cnc23)oc2ccc(F)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.49
PIK3CG P48736 3/20 0.49
MAP4K4 O95819 4/20 0.39
AURKA O14965 3/20 0.39
AURKB Q96GD4 3/20 0.39
CLK4 Q9HAZ1 2/20 0.39
DAPK3 O43293 1/20 0.39
JAK2 O60674 1/20 0.39
PRKD3 O94806 1/20 0.39
PAK4 O96013 1/20 0.39
ABL1 P00519 1/20 0.39
LCK P06239 1/20 0.39
CSF1R P07333 1/20 0.39
RET P07949 1/20 0.39
PDGFRB P09619 1/20 0.39
FGFR1 P11362 1/20 0.39
PRKACA P17612 1/20 0.39
FLT1 P17948 1/20 0.39
LTK P29376 1/20 0.39
GRK5 P34947 1/20 0.39

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
SCHEMBL8946 1.00 PIK3CD (0.49) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL30670914 0.95 PIK3CD (0.55) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL8975 0.95 PIK3CD (0.55) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL30670869 0.94 PIK3CD (0.44) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL8721 0.94 PIK3CD (0.44) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL15688348 0.91 PIK3CD (0.47) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL8573 0.86 PIK3CD (0.54) PIK3CDPIK3CGMAP4K4MAPK14GABRP
SCHEMBL16783465 0.85 PIK3CD (0.45) PIK3CDPIK3CGMAP4K4AURKAAURKB
SCHEMBL8546 0.84 PIK3CD (0.43) PIK3CDPIK3CGAURKAMAPK14MEN1
SCHEMBL16395748 0.84 PIK3CD (0.53) PIK3CDPIK3CGMAP4K4MAPK14GABRP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117222413-A Methods and combinations for treating tumors 同润生物医药(上海)有限公司 2023-12-12 CN claimed
CN-117222413-A Methods and combinations for treating tumors 同润生物医药(上海)有限公司 2023-12-12 CN disclosed