SCHEMBL4435013

SCHEMBL4435013

Fc1ccc2cc(CCNc3ncnc4[nH]cnc34)c(-c3cccs3)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
GPBAR1 Q8TDU6 1/20 0.36
ADK P55263 1/20 0.35
HTT P42858 4/20 0.33
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPK1 P28482 3/20 0.33
AURKB Q96GD4 4/20 0.33
AURKA O14965 3/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAP4K4 O95819 2/20 0.32
DAPK3 O43293 1/20 0.32
JAK2 O60674 1/20 0.32
PRKD3 O94806 1/20 0.32
PAK4 O96013 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
SCHEMBL17240937 0.83 PIK3CG (0.52) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL4432954 0.82 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CGHTT
Water SCHEMBL17240976 0.82 PIK3CG (0.51) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL4442948 0.81 PIK3CG (0.43) PIK3CDPIK3CAPIK3CBPIK3CGGPBAR1
SCHEMBL4442917 0.80 PIK3CD (0.42) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL248986 0.79 PIK3CD (0.40) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL248495 0.79 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL246483 0.79 MAP4K4 (0.38) PIK3CDPIK3CAPIK3CBPIK3CGHTT
SCHEMBL4179139 0.79 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPIK3CGAURKB
SCHEMBL27781176 0.79 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPIK3CGAURKB

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
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed