SCHEMBL9045282

SCHEMBL9045282

O=C(O)c1cn(-c2ccon2)c2cc(F)c(F)cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 4/20 0.43
HSD17B10 Q99714 3/20 0.43
TOP1 P11387 1/20 0.40
HTT P42858 2/20 0.39
CAPN1 P07384 1/20 0.38
POLB P06746 2/20 0.38
HSP90AA1 P07900 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
DRD3 P35462 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
EPHA2 P29317 1/20 0.36
FLT4 P35916 1/20 0.36
GSK3B P49841 1/20 0.36
RARB P10826 1/20 0.36
TBXAS1 P24557 1/20 0.36

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
SCHEMBL9046936 0.83 KMT2A (0.54) LMNAKMT2AALDH1A1KDM4EHPGD
SCHEMBL9046944 0.83 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDHSD17B10TOP1
SCHEMBL9044750 0.81 ALDH1A1 (0.41) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL7011787 0.81 ALDH1A1 (0.40) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9045879 0.81 ALDH1A1 (0.40) ALDH1A1KDM4ETOP1HTTPOLB
SCHEMBL9047564 0.81 ALDH1A1 (0.40) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9047265 0.81 ALDH1A1 (0.40) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9048751 0.81 TOP1 (0.45) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9048305 0.80 LMNA (0.47) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9045251 0.80 LMNA (0.47) LMNAKMT2AMEN1ALDH1A1KDM4E

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
EP-0700912-A1 QUINOLONE DERIVATIVE OR SALT THEREOF, AND ANTIBACTERIAL CONTAINING THE SAME WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1996-03-13 EP disclosed