SCHEMBL8568046

SCHEMBL8568046

O=C(Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21)c1cc(F)c(F)c(F)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 9/20 0.77
MEN1 O00255 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
HTT P42858 1/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
SMAD3 P84022 1/20 0.55
KMT2A Q03164 1/20 0.55
PRMT1 Q99873 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
JAK2 O60674 2/20 0.47
DRD1 P21728 2/20 0.46
MAPK10 P53779 2/20 0.45
MAPK14 Q16539 2/20 0.45
NAALAD2 Q9Y3Q0 1/20 0.45
LGALS1 P09382 1/20 0.44
LGALS3 P17931 1/20 0.44

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
SCHEMBL1032050 0.88 FTO (0.74) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL8567853 0.87 FTO (1.00) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL8571494 0.84 FTO (0.71) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL8580142 0.84 FTO (0.88) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL29810840 0.84 FTO (0.92) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL29938908 0.82 FTO (1.00) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL4600340 0.82 FTO (0.79) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL543293 0.82 FTO (1.00) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL8571832 0.81 FTO (0.74) FTOMEN1MAPTHPGDCYP2C19
SCHEMBL14213150 0.80 FTO (0.79) FTOMEN1MAPTHPGDCYP2C19

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
US-5773236-A FLUORESCENT DYES FOR DETECTION OF ENZYMES FOR METABOLISM IN CELLS MOLECULE PROBES, INC. (US) 1998-06-30 US disclosed