SCHEMBL9525804

SCHEMBL9525804

CC1Sc2c(C(=O)O)c(=O)c3cc(F)c(N4CCNC(=O)C4)cc3n21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.58
PIM1 P11309 2/20 0.51
GSK3A P49840 2/20 0.51
GSK3B P49841 2/20 0.51
PIM3 Q86V86 2/20 0.51
PRKD3 O94806 1/20 0.51
IRAK1 P51617 1/20 0.51
RPS6KA3 P51812 1/20 0.51
DYRK1A Q13627 1/20 0.51
CSNK1G3 Q9Y6M4 1/20 0.51
ALDH1A1 P00352 8/20 0.43
KDM4E B2RXH2 7/20 0.43
HSD17B10 Q99714 6/20 0.43
HPGD P15428 6/20 0.43
BRD4 O60885 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
CYP2J2 P51589 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP1A2 P05177 1/20 0.41

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
Ulifloxacin SCHEMBL29360160 0.88 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1148819 0.88 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1148757 0.88 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1149364 0.88 LMNA (0.64) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1148707 0.87 LMNA (0.63) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9523923 0.86 LMNA (0.59) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL9522209 0.85 LMNA (0.67) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1149252 0.85 LMNA (0.61) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL10564853 0.84 LMNA (0.66) LMNAPIM1GSK3AGSK3BPIM3
Ulifloxacin SCHEMBL1149423 0.84 LMNA (0.60) LMNAPIM1GSK3AGSK3BPIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249043-B1 QUINOLINECARBOXYLIC ACID DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-08-04 EP disclosed
US-4843070-A BACTERIDCIDES, FUNGICIDES NIPPON SHINYAKU CO., LTD. (JP) 1989-06-27 US disclosed
EP-0249043-A2 Quinolinecarboxylic acid derivatives NIPPON SHINYAKU COMPANY, LIMITED (JP) 1987-12-16 EP disclosed