SCHEMBL4089333

SCHEMBL4089333

CCOC(=O)c1c(SCC)nc2cc(F)c(F)cc2c1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 5/20 0.36
TSHR P16473 2/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
PRNP P04156 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 4/20 0.33
NPC1 O15118 3/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HSD17B10 Q99714 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 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
SCHEMBL30680339 0.92 MAPT (0.40) MAPTTSHRTHRBALDH1A1SMN1; SMN2
SCHEMBL30680368 0.92 MAPT (0.40) MAPTTSHRTHRBALDH1A1SMN1; SMN2
SCHEMBL3100597 0.86 SMN1; SMN2 (0.40) KMT2AMEN1MAPTTSHRALDH1A1
SCHEMBL4088923 0.84 CFTR (0.41) KMT2AMEN1MAPTTSHRALDH1A1
SCHEMBL9234896 0.80 ALDH1A1 (0.38) KMT2AMEN1MAPTTSHRTHRB
SCHEMBL9228657 0.79 ALDH1A1 (0.43) KMT2AMEN1MAPTTSHRTHRB
SCHEMBL9231514 0.78 KMT2A (0.40) KMT2AMEN1MAPTTHRBALDH1A1
SCHEMBL1723448 0.77 MAPT (0.35) KMT2AMEN1MAPTTSHRALDH1A1
Anisole SCHEMBL8752987 0.76 GAA (0.36) KMT2AMEN1MAPTTHRBALDH1A1
SCHEMBL30680350 0.76 ALDH1A1 (0.39) MAPTTSHRALDH1A1TDP1RAB9A

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
WO-2009093268-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE PRULIFLOXACIN IND-SWIFT LABORATORIES LIMITED (IN) 2009-07-30 WO claimed
WO-2009093268-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE PRULIFLOXACIN IND-SWIFT LABORATORIES LIMITED (IN) 2009-07-30 WO disclosed