SCHEMBL16665740

SCHEMBL16665740

C=CCOc1cc(O)cc(-c2n[nH]c3ncnc(N)c23)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 0.38
ABL1 P00519 3/20 0.38
PIK3CD O00329 8/20 0.36
PIK3CA P42336 7/20 0.36
PIK3CB P42338 7/20 0.36
PIK3CG P48736 7/20 0.36
PRKDC P78527 7/20 0.36
FGFR1 P11362 7/20 0.33
FGFR2 P21802 7/20 0.33
FGFR3 P22607 7/20 0.33
FGFR4 P22455 6/20 0.33
EGFR P00533 2/20 0.32
HCK P08631 2/20 0.32
KDR P35968 2/20 0.32
MTOR P42345 2/20 0.32
EPHB4 P54760 2/20 0.32
PI4KB Q9UBF8 2/20 0.32
NPC1 O15118 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL16665750 0.86 FGFR1 (0.39) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL16665742 0.80 PIK3CG (0.41) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL23917472 0.77 SRC (0.52) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL16065725 0.75 PIK3CD (0.53) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL16665792 0.74 SRC (0.45) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19414400 0.72 CYP1A1 (0.47) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL11405 0.71 PIK3CG (0.61) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL23917564 0.71 FGFR1 (0.43) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL16655314 0.70 PIK3CD (0.69) SRCABL1PIK3CDPIK3CAPIK3CB
SCHEMBL11325 0.70 PIK3CG (0.49) SRCABL1PIK3CDPIK3CAPIK3CB

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-2015058084-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-23 WO disclosed