SCHEMBL5312746

SCHEMBL5312746

Cc1ccc(N(C)c2ccc3nc(Nc4cc(CC(=O)N(C)CCO)ccn4)sc3n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.37
IRAK4 Q9NWZ3 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
NR3C2 P08235 1/20 0.32
KDR P35968 3/20 0.31
BRAF P15056 3/20 0.31
RAF1 P04049 1/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30

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
SCHEMBL5311529 0.88 LCK (0.39) LCKIRAK4KDM4EMAPTNR3C2
SCHEMBL14530871 0.88 LCK (0.39) LCKIRAK4KDM4EMAPTNR3C2
SCHEMBL5311989 0.87 LCK (0.37) LCKIRAK4KDM4EMAPTKDR
SCHEMBL5313272 0.87 LCK (0.38) LCKIRAK4KDM4EMAPTKDR
SCHEMBL5312890 0.86 LCK (0.38) LCKIRAK4KDM4EMAPTNR3C2
SCHEMBL5309870 0.86 LCK (0.37) LCKIRAK4KDM4EMAPTNR3C2
SCHEMBL5316887 0.86 LCK (0.38) LCKIRAK4KDM4EMAPTNR3C2
SCHEMBL5315891 0.86 LCK (0.35) LCKIRAK4NR3C2
SCHEMBL5312823 0.85 LCK (0.35) LCKIRAK4KDM4EMAPTKDR
SCHEMBL5312033 0.85 LCK (0.36) LCKIRAK4NR3C2KDRBRAF

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO claimed
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed