SCHEMBL6927192

SCHEMBL6927192

NC(=O)OCCn1cccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.39
FDPS P14324 1/20 0.39
IDO1 P14902 1/20 0.38
LMNA P02545 3/20 0.36
DAO P14920 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HTT P42858 1/20 0.36
GLA P06280 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
KDM5A P29375 1/20 0.35

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
SCHEMBL14578728 0.82 THRB (0.42) THRBFDPSIDO1LMNADAO
SCHEMBL28346495 0.81 FDPS (0.41) THRBFDPSTDP1HDAC1HDAC6
SCHEMBL27405933 0.81 KDM4E (0.45) THRBFDPSIDO1LMNADAO
SCHEMBL28396291 0.78 THRB (0.46) THRBFDPSIDO1LMNADAO
SCHEMBL27376702 0.78 THRB (0.42) THRBFDPSIDO1LMNATDP1
SCHEMBL27556218 0.76 LMNA (0.54) IDO1LMNATDP1HTTKDM5A
SCHEMBL25623685 0.76 THRB (0.38) THRBFDPSIDO1LMNADAO
SCHEMBL1178459 0.76 LMNA (0.45) THRBFDPSLMNADAOTDP1
SCHEMBL14466608 0.75
SCHEMBL5395889 0.74 THRB (0.37) THRBFDPSIDO1LMNADAO

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-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 WO disclosed