SCHEMBL6692701

SCHEMBL6692701

COC(=O)c1cccc2c1NC(=O)C2=Cc1cc(C)c(O)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.49
RAF1 P04049 2/20 0.47
AURKA O14965 1/20 0.47
DHFR P00374 1/20 0.46
RET P07949 1/20 0.44
PLK4 O00444 1/20 0.42
PLK1 P53350 1/20 0.42
PAK1 Q13153 1/20 0.42
EGFR P00533 2/20 0.41
ERBB2 P04626 2/20 0.41
IGF1R P08069 2/20 0.41
PDGFRB P09619 1/20 0.41
NOX4 Q9NPH5 1/20 0.41
PSD A5PKW4 1/20 0.41
EEF2K O00418 1/20 0.41
SRC P12931 1/20 0.41
SIRT1 Q96EB6 2/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
GSK3B P49841 3/20 0.40

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
SCHEMBL6692699 1.00 LRRK2 (0.49) LRRK2RAF1AURKADHFRRET
SCHEMBL6690293 0.89 RAF1 (0.47) LRRK2RAF1AURKADHFRRET
SCHEMBL6690291 0.89 RAF1 (0.47) LRRK2RAF1AURKADHFRRET
SCHEMBL6687681 0.88 RAF1 (0.62) LRRK2RAF1AURKADHFRPLK4
SCHEMBL6687680 0.88 RAF1 (0.62) LRRK2RAF1AURKADHFRPLK4
SCHEMBL6697120 0.80 RAF1 (0.54) LRRK2RAF1DHFRPLK4PLK1
SCHEMBL6533506 0.77 MAPT (0.46) RAF1AURKAPLK4PLK1NOX4
SCHEMBL6533508 0.77 MAPT (0.46) RAF1AURKAPLK4PLK1NOX4
SCHEMBL5476173 0.74 RAF1 (0.71) LRRK2RAF1AURKADHFRRET
SCHEMBL5476171 0.74 RAF1 (0.71) LRRK2RAF1AURKADHFRRET

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-2004069998-A2 OXINDOLE DERIVATIVES AS ANTIMICROBIAL AGENTS ARROW THERAPEUTICS LIMITED (GB) 2004-08-19 WO disclosed