SCHEMBL7915933

SCHEMBL7915933

COc1ncc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)N)cc5)c4c3n2)cn1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 19/20 0.81
▸ MTOR P42345 19/20 0.81
▸ LCK P06239 1/20 0.43
▸ LYN P07948 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ EPHA1 P21709 1/20 0.43
▸ AXL P30530 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ TEK Q02763 1/20 0.43
▸ PRKD1 Q15139 1/20 0.43
▸ ALK Q9UM73 1/20 0.43

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
SCHEMBL2285699 0.89 PIK3CA (1.00) PIK3CAMTOR
SCHEMBL7921952 0.87 MTOR (0.63) PIK3CAMTORLCKLYNSRC
SCHEMBL7925383 0.86 PIK3CA (0.82) PIK3CAMTORLCKLYNSRC
SCHEMBL7924992 0.85 PIK3CA (0.59) PIK3CAMTORLCKLYNSRC
SCHEMBL7913788 0.85 MTOR (0.81) PIK3CAMTORLCKLYNSRC
SCHEMBL7923878 0.84 MTOR (0.81) PIK3CAMTORLCKLYNSRC
SCHEMBL7923875 0.83 PIK3CA (0.79) PIK3CAMTOR
SCHEMBL15616017 0.80 PIK3CA (0.83) PIK3CAMTORLCKLYNSRC
SCHEMBL2284454 0.80 MTOR (1.00) PIK3CAMTOR
SCHEMBL2283736 0.76 PIK3CA (1.00) PIK3CAMTORLCKLYNSRC

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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