SCHEMBL3014039

SCHEMBL3014039

N#CC1CCN(C2COC(=O)N2c2ccccc2)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.33
LTA4H P09960 1/20 0.32
RORC P51449 1/20 0.31
GRM5 P41594 1/20 0.31
USP30 Q70CQ3 4/20 0.31
QPCT Q16769 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 2/20 0.30

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
SCHEMBL2945346 0.93 GRM5 (0.32) NOTUMGRM5USP30QPCTALDH1A1
SCHEMBL6760968 0.80 NOTUM (0.34) NOTUMGRM5
SCHEMBL7814733 0.77 ALDH1A1 (0.41) NOTUMGRM5QPCTKDM4EALDH1A1
SCHEMBL7823338 0.77 NOTUM (0.40) NOTUMGRM5QPCTALDH1A1
SCHEMBL1843567 0.76 ALDH1A1 (0.43) NOTUMGRM5QPCTKDM4EALDH1A1
SCHEMBL3573592 0.74 NOTUM (0.38) NOTUMGRM5QPCTALDH1A1HSD11B1
SCHEMBL3586944 0.74 ALDH1A1 (0.33) NOTUMQPCTALDH1A1HSD11B1
SCHEMBL28296440 0.73 NOTUM (0.33) NOTUMQPCT
SCHEMBL3260136 0.73 SIGMAR1 (0.42) NOTUMQPCTALDH1A1
SCHEMBL3580768 0.71 ALDH1A1 (0.31) NOTUMALDH1A1

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
CN-102112471-A 3-cyanopyrrolidinyl-phenyl-oxazolidinones as antibacterial agents FERRER INT 2011-06-29 CN disclosed
EP-2141161-A1 3-cyanopyrrolidinyl-phenyl-oxazolidinones as antibacterial agents Ferrer Internacional, S.A. (ES) 2010-01-06 EP disclosed