SCHEMBL6431038

SCHEMBL6431038

CCN(CC)C(C(N)=O)n1c(C)c(C(=O)O)c(C)c1C=C1C(=O)Nc2cccc(-c3ccc(OC)cc3)c21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 10/20 0.36
▸ FLT3 P36888 5/20 0.36
▸ KIT P10721 2/20 0.36
▸ FLT4 P35916 2/20 0.36
▸ PDGFRB P09619 8/20 0.35
▸ AURKB Q96GD4 3/20 0.35
▸ AURKA O14965 2/20 0.35
▸ MET P08581 1/20 0.35
▸ AURKC Q9UQB9 1/20 0.35
▸ TGM2 P21980 1/20 0.35
▸ FGFR1 P11362 7/20 0.35
▸ EGFR P00533 4/20 0.35
▸ RET P07949 1/20 0.34
▸ PDGFRA P16234 1/20 0.33
▸ NTSR1 P30989 1/20 0.33
▸ MDM2 Q00987 1/20 0.33

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
SCHEMBL7009166 0.84 KDR (0.37) KDRFLT3KITFLT4PDGFRB
SCHEMBL2114117 0.80 KDR (0.46) KDRFLT3KITFLT4PDGFRB
SCHEMBL2114116 0.80 LRRK2 (0.42) KDRFLT3KITFLT4PDGFRB
SCHEMBL2116248 0.78 KDR (0.40) KDRFLT3KITFLT4PDGFRB
SCHEMBL2116213 0.77 FGFR1 (0.51) KDRFLT3KITFLT4PDGFRB
SCHEMBL722802 0.76 ALK (0.52) KDRFLT3KITFLT4PDGFRB
SCHEMBL2116963 0.76 PDGFRB (0.46) KDRKITPDGFRBFGFR1EGFR
SCHEMBL2114389 0.75 FLT3 (0.41) KDRFLT3KITFLT4PDGFRB
SCHEMBL6324208 0.73 FLT3 (0.60) KDRFLT3KITFLT4PDGFRB
SCHEMBL6324202 0.73 FLT3 (0.60) KDRFLT3KITFLT4PDGFRB

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
US-6861418-B2 4-aryl substituted indolinones SUGEN, INC. (US) 2005-03-01 — — US disclosed
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