SCHEMBL5536009

SCHEMBL5536009

CCOC(=O)c1c(CC)[nH]c2c(F)c(F)c(F)c(COC(C)=O)c2c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MITF O75030 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.34
STAT3 P40763 1/20 0.34
ALOX5 P09917 3/20 0.34
PTGES O14684 1/20 0.34
MAPK1 P28482 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP12 P39900 1/20 0.33

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
SCHEMBL7113113 0.72 ALDH1A1 (0.45) RAB9ANPC1SMN1; SMN2TP53NPSR1
SCHEMBL44341 0.66 CA2 (0.46) SMN1; SMN2HSD17B10CYP1A2CYP2C19ALDH1A1
SCHEMBL10771019 0.64 ALOX5 (0.46) RAB9ANPC1SMN1; SMN2TP53NPSR1
SCHEMBL22758888 0.63 CA2 (0.41) RAB9AHSD17B10CYP1A2CYP2C19ALDH1A1
SCHEMBL6578769 0.62 SMN1; SMN2 (0.53) RAB9ANPC1SMN1; SMN2TP53NPSR1
SCHEMBL196046 0.62 ESR1 (0.53) RAB9ANPC1SMN1; SMN2TP53NPSR1
SCHEMBL11647887 0.62 HPGD (0.53) SMN1; SMN2HSD17B10CYP1A2CYP2C19ALDH1A1
SCHEMBL1786267 0.61 MEN1 (0.43) HSD17B10CYP1A2CYP2C19ALDH1A1KDM4E
SCHEMBL8911652 0.61 CYP1A2 (0.44) RAB9ANPSR1RECQLCYP1A2CYP2C19
SCHEMBL12130985 0.61 ALDH1A1 (0.43) RAB9ANPC1SMN1; SMN2TP53NPSR1

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-1809637-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF LEVOFLOXACIN HEMIHYDRATE Neuland Laboratories Ltd (IN) 2007-07-25 EP disclosed
WO-2006048889-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF LEVOFLOXACIN HEMIHYDRATE NEULAND LABORATORIES LTD. (IN) 2006-05-11 WO disclosed