SCHEMBL2718969

SCHEMBL2718969

N#Cc1c(O)ncnc1NCCc1nc2ccc(F)cc2cc1-c1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.53
PIK3CG P48736 16/20 0.53
PIK3CB P42338 15/20 0.43
PIK3CA P42336 14/20 0.43
CASP6 P55212 1/20 0.39
CYP2D6 P10635 1/20 0.38
HTT P42858 1/20 0.37
SQOR Q9Y6N5 1/20 0.36
PIK3R1 P27986 1/20 0.36

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
SCHEMBL2720072 0.90 PIK3CD (0.65) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL3777095 0.79 PIK3CD (0.82) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2717715 0.79 PIK3CD (0.44) PIK3CDPIK3CGPIK3CBPIK3CACASP6
SCHEMBL15320448 0.77 PIK3CD (0.52) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL6122150 0.76 PIK3CD (0.65) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2718941 0.76 PIK3CD (0.65) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2717528 0.76 PIK3CD (0.45) PIK3CDPIK3CGPIK3CBPIK3CACASP6
SCHEMBL2720253 0.76 PIK3CD (0.49) PIK3CDPIK3CGPIK3CBPIK3CAPIK3R1
SCHEMBL2717781 0.76 PIK3CD (0.40) PIK3CDPIK3CGCASP6CYP2D6HTT
SCHEMBL2718967 0.74 PIK3CD (0.51) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6

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-2445900-A2 POLYCYCLIC DERIVATIVES OF PYRIDINE AND THEIR USE IN THE TREATMENT OF (INTER ALIA) RHEUMATOID ARTHRITIS AND SIMILAR DISEASES Amgen, Inc (US) 2012-05-02 EP disclosed
WO-2010151740-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 WO disclosed