SCHEMBL263349

SCHEMBL263349

CCOC(=O)/C=C/CCc1cn(C2CCCC2)c2cc(NC3CCCCC3)c(F)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
FOXO1 Q12778 1/20 0.36
ALOX15 P16050 1/20 0.35
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
BRD4 O60885 1/20 0.33
CASP3 P42574 5/20 0.33
ADRB2 P07550 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL4180729 0.89 MEN1 (0.47) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL4180728 0.89 MEN1 (0.47) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL262545 0.87 MEN1 (0.45) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL263352 0.85 MEN1 (0.49) MEN1GAAKMT2ACNR2FOXO1
SCHEMBL261963 0.84 MEN1 (0.49) MEN1GAAKMT2ACNR1CNR2
SCHEMBL4169519 0.84 MEN1 (0.46) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL4169523 0.84 MEN1 (0.46) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL263351 0.81 MEN1 (0.47) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL263832 0.81 MEN1 (0.51) MEN1GAAKMT2AFOXO1ALDH1A1
SCHEMBL4172238 0.80 MEN1 (0.51) MEN1GAAKMT2AFOXO1ALDH1A1

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