SCHEMBL16769867

SCHEMBL16769867

Cc1cc(OCc2ccc(CO)nc2)cc(Oc2ccc(-c3cn(C(C)C)c4ncnc(N)c34)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.67
▸ TEK Q02763 14/20 0.67
▸ LCK P06239 12/20 0.58
▸ SRC P12931 3/20 0.58
▸ PIK3CD O00329 1/20 0.47
▸ PIK3CA P42336 1/20 0.47
▸ PIK3CB P42338 1/20 0.47
▸ PIK3CG P48736 1/20 0.47
▸ PRKDC P78527 1/20 0.47
▸ EGFR P00533 4/20 0.44
▸ ABL1 P00519 3/20 0.44
▸ ABL2 P42684 3/20 0.44
▸ FYN P06241 1/20 0.42
▸ RET P07949 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ FLT1 P17948 1/20 0.42
▸ LTK P29376 1/20 0.42
▸ MAP2K2 P36507 1/20 0.42
▸ FLT3 P36888 1/20 0.42

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
SCHEMBL16769955 0.93 KDR (0.66) KDRTEKLCKSRCPIK3CD
SCHEMBL16769950 0.85 KDR (0.63) KDRTEKLCKSRCPIK3CD
SCHEMBL16769806 0.83 TEK (0.66) KDRTEKLCKSRCPIK3CD
SCHEMBL16769986 0.83 KDR (0.62) KDRTEKLCKSRCPIK3CD
SCHEMBL2071955 0.81 KDR (1.00) KDRTEKLCKSRCPIK3CD
SCHEMBL16769925 0.80 TEK (0.61) KDRTEKLCKSRCPIK3CD
SCHEMBL16769999 0.80 TEK (0.64) KDRTEKLCKSRCPIK3CD
SCHEMBL16769952 0.79 TEK (0.71) KDRTEKLCKSRCPIK3CD
SCHEMBL18925744 0.78 TEK (0.59) KDRTEKLCKSRCPIK3CD
SCHEMBL18925730 0.78 TEK (0.51) KDRTEKLCKSRCPIK3CD

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-2015077866-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE INC. (CA) 2015-06-04 — — WO disclosed
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