SCHEMBL262907

SCHEMBL262907

CCOC(=O)/C=C(\C)COc1cn(C2CCCC2)c2cc(NC3CCCCC3)c(F)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GAA P10253 2/20 0.45
FOXO1 Q12778 1/20 0.37
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ALOX15 P16050 2/20 0.35
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CASP3 P42574 3/20 0.34
PPOX P50336 1/20 0.33
HTT P42858 1/20 0.33
BRD4 O60885 1/20 0.33
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADRB2 P07550 1/20 0.32

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
SCHEMBL4169053 0.90 MEN1 (0.46) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL4169061 0.90 MEN1 (0.46) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL14248206 0.88 MEN1 (0.49) MEN1KMT2AGAAFOXO1ALOX15
SCHEMBL262975 0.86 MEN1 (0.50) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL10146400 0.84 MEN1 (0.50) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL14248104 0.83 MEN1 (0.49) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL261963 0.80 MEN1 (0.49) MEN1KMT2AGAAFOXO1CNR1
SCHEMBL14247997 0.80 MEN1 (0.49) MEN1KMT2AGAAFOXO1ALOX15
SCHEMBL260972 0.80 MEN1 (0.46) MEN1KMT2AGAAFOXO1ALDH1A1
SCHEMBL14247912 0.80 MEN1 (0.48) MEN1KMT2AGAAFOXO1ALOX15

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133882-B2 Quinolone derivative or pharmaceutically acceptable salt thereof ASTELLAS PHARMA INC (JP) 2012-03-13 US disclosed
EP-1995240-B1 QUINOLONE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-02-22 EP disclosed