SCHEMBL9215466

SCHEMBL9215466

O=C(O)c1c(N2COC(CO)C2)n(C2CC2)c2c(F)cc(F)cc2c1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
CYP1A2 P05177 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PIM1 P11309 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
PIM3 Q86V86 1/20 0.33
CSNK1G1 Q9HCP0 1/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
KCNH2 Q12809 3/20 0.32
TOP2A P11388 7/20 0.32
TOP2B Q02880 7/20 0.32
LMNA P02545 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9249913 0.75 KCNH2 (0.41) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9244385 0.74 KCNH2 (0.41) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9634933 0.74 PIM1 (0.38) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL28409035 0.73 KDM4E (0.52) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL28441029 0.73 KDM4E (0.52) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9129070 0.72 PIM1 (0.37) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9129061 0.72 PIM1 (0.37) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9727831 0.71 TOP2A (0.53) KDM4EALDH1A1POLBCHRM2CHRM1
SCHEMBL9574531 0.69 KDM4E (0.35) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A
SCHEMBL9865158 0.68 KDM4E (0.36) KDM4ECYP1A2SMN1; SMN2PIM1GSK3A

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
EP-0390215-B1 Quinolone derivatives and salts thereof, preparation process es thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KK (JP) 1995-06-07 EP disclosed
EP-0390215-A2 Quinolone derivatives and salts thereof, preparation process es thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1990-10-03 EP disclosed