SCHEMBL5340171

SCHEMBL5340171

CC(C)Oc1ccc(-c2cc(Oc3cccc(C(F)(F)F)c3)cc3[nH]c(C(=O)O)c(NC(=O)C(C)(C)C)c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
KMT2A Q03164 2/20 0.36
CLK1 P49759 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
ALOX12 P18054 1/20 0.36
CCR6 P51684 1/20 0.36
CHEK2 O96017 1/20 0.36
MCL1 Q07820 1/20 0.36
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
PTGER4 P35408 1/20 0.35
DUSP3 P51452 1/20 0.35
PTPN5 P54829 1/20 0.35
PTPN11 Q06124 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDR P35968 2/20 0.34
TEK Q02763 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL5269638 0.77 MAPT (0.39) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL5339470 0.76 GPR35 (0.37) MAPTKMT2ACLK1MCL1PTPN5
SCHEMBL5272029 0.75 GPR35 (0.48) MAPTKMT2ACLK1MEN1ALDH1A1
SCHEMBL4914051 0.72 PPARG (0.52)
SCHEMBL5270761 0.70 PPARD (0.33) MAPTALDH1A1
SCHEMBL5336273 0.68 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL5343008 0.66 GPR17 (0.44) MAPTKMT2AMEN1ALDH1A1MCL1
SCHEMBL5501032 0.65 THRA (0.40) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL5273891 0.65 KDM4E (0.51) MAPTKMT2AMEN1ALDH1A1MCL1
SCHEMBL178468 0.64 ALDH1A1 (0.53) MAPTKMT2AMEN1ALDH1A1GAA

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-2007043677-A9 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2007-06-07 WO disclosed