SCHEMBL10374530

SCHEMBL10374530

CC1CN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)CC1NC(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.51
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 4/20 0.51
POLB P06746 2/20 0.51
OPRM1 P35372 2/20 0.51
HSD17B10 Q99714 2/20 0.51
PRKD3 O94806 1/20 0.51
ALOX15 P16050 1/20 0.51
CLK2 P49760 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TOP2A P11388 5/20 0.51
TOP2B Q02880 5/20 0.51
LMNA P02545 1/20 0.49
CHRM2 P08172 1/20 0.49
CHRM1 P11229 1/20 0.49
OPRD1 P41143 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48

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
SCHEMBL10375599 1.00 KCNH2 (0.51) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10687624 1.00 KCNH2 (0.51) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10375597 1.00 KCNH2 (0.51) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10687644 1.00 KCNH2 (0.51) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10457825 0.93 KCNH2 (0.57) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10681637 0.93 ALDH1A1 (0.59) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10375997 0.93 ALDH1A1 (0.59) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL10681621 0.93 ALDH1A1 (0.59) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL8446277 0.92 KDM4E (0.63) KCNH2KDM4EALDH1A1HPGDPOLB
SCHEMBL9376082 0.92 KDM4E (0.63) KCNH2KDM4EALDH1A1HPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4753953-A Pyridonecarboxylic acid derivatives and antibacterial pharmaceutical compositions thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 1988-06-28 US claimed
EP-0208210-B1 PYRIDONECARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION KYORIN PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 EP disclosed
US-4753953-A Pyridonecarboxylic acid derivatives and antibacterial pharmaceutical compositions thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 1988-06-28 US disclosed
EP-0208210-A1 Pyridonecarboxylic acid derivatives and process for their preparation KYORIN PHARMACEUTICAL CO., LTD. (JP) 1987-01-14 EP disclosed