SCHEMBL7923878

SCHEMBL7923878

Cn1cc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)N)cc5)c4c3n2)cn1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 19/20 0.81
▸ PIK3CA P42336 18/20 0.81
▸ PIK3CD O00329 1/20 0.42
▸ PIK3CB P42338 1/20 0.42
▸ PIK3CG P48736 1/20 0.42
▸ LCK P06239 1/20 0.41
▸ LYN P07948 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ EPHA1 P21709 1/20 0.41
▸ AXL P30530 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ TEK Q02763 1/20 0.41
▸ PRKD1 Q15139 1/20 0.41
▸ ALK Q9UM73 1/20 0.41

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
SCHEMBL2281788 0.89 PIK3CA (1.00) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL7921952 0.85 MTOR (0.63) MTORPIK3CALCKLYNSRC
SCHEMBL7915933 0.84 PIK3CA (0.81) MTORPIK3CALCKLYNSRC
SCHEMBL7913788 0.83 MTOR (0.81) MTORPIK3CALCKLYNSRC
SCHEMBL7924992 0.83 PIK3CA (0.59) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15616024 0.80 PIK3CA (0.83) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL7925383 0.79 PIK3CA (0.82) MTORPIK3CALCKLYNSRC
SCHEMBL2281822 0.74 MTOR (0.79) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL2284471 0.74 PIK3CA (1.00) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17715267 0.74 PIK3CA (0.59) MTORPIK3CA

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-2010038165-A1 IMIDAZO[1,5]NAPHTHYRIDINE COMPOUNDS, THEIR PHARMACEUTICAL USE AND COMPOSITIONS PFIZER INC. (US) 2010-04-08 — — WO disclosed
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