SCHEMBL2945343

SCHEMBL2945343

N#CC1CCCN(c2ccccc2N2CCOC2=O)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.36
PIM1 P11309 3/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
PDE10A Q9Y233 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
CHRM5 P08912 1/20 0.33
USP30 Q70CQ3 1/20 0.32
KDM4E B2RXH2 1/20 0.32
JAK2 O60674 1/20 0.32
TYK2 P29597 1/20 0.32
DPP4 P27487 2/20 0.32
CAMK1D Q8IU85 1/20 0.32
PIK3CA P42336 1/20 0.32
GRM2 Q14416 2/20 0.31
FPR1 P21462 1/20 0.31
FPR2 P25090 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL3014037 0.93 KDM4E (0.39) UCHL1PIM1PIM3PIM2USP30
SCHEMBL7823337 0.78 KEAP1 (0.42) KDM4EMAPT
SCHEMBL7814732 0.78 KEAP1 (0.46) MAPT
SCHEMBL1843566 0.77 KEAP1 (0.49) PIM1MAPT
SCHEMBL4359875 0.74 AR (0.44) UCHL1USP30KDM4EDPP4MAPT
SCHEMBL2530053 0.70 GRM2 (0.45) KDM4EGRM2TP53
SCHEMBL3584707 0.70 ALOX15 (0.37) KDM4EPIK3CAMAPT
SCHEMBL6984223 0.69 ADRB1 (0.49) PIM1PIM3PIM2KDM4E
SCHEMBL7812796 0.67 FAAH (0.36) KDM4EFPR1FPR2
SCHEMBL4880316 0.67 AR (0.67)

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