SCHEMBL16686018

SCHEMBL16686018

CCOC(=O)C1CC(OCc2ccc(OC)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 2/20 0.45
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 2/20 0.44
GLA P06280 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
NAAA Q02083 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 1/20 0.43
FABP7 O15540 1/20 0.41
FABP5 Q01469 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
SCHEMBL6928220 0.86 CDK5 (0.48) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL12055622 0.85 LMNA (0.43) SMN1; SMN2POLBALDH1A1KMT2AKDM4E
SCHEMBL2605500 0.85 PKM (0.49) POLBALDH1A1KMT2AKDM4EMAPT
SCHEMBL8350324 0.85 PKM (0.49) POLBALDH1A1KMT2AKDM4EMAPT
SCHEMBL8351735 0.85 PKM (0.49) POLBALDH1A1KMT2AKDM4EMAPT
SCHEMBL1934310 0.84 CA1 (0.48) ALDH1A1KMT2AGLANAAAMEN1
SCHEMBL8707251 0.83 GAA (0.49) GAANPC1RAB9ASMN1; SMN2POLB
SCHEMBL8707255 0.83 GAA (0.49) GAANPC1RAB9ASMN1; SMN2POLB
SCHEMBL18855407 0.82 GAA (0.44) GAARAB9ASMN1; SMN2MAPTNAAA
SCHEMBL12032617 0.82 GAA (0.44) GAARAB9ASMN1; SMN2MAPTNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015066413-A1 OXAZOLIDINONE HYDROXAMIC ACID COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2015-05-07 WO disclosed