SCHEMBL3014037

SCHEMBL3014037

N#CC1CCN(c2ccccc2N2CCOC2=O)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.37
RORC P51449 1/20 0.34
USP30 Q70CQ3 3/20 0.33
PIM1 P11309 2/20 0.33
PIM3 Q86V86 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
UCHL1 P09936 1/20 0.33
NOTUM Q6P988 2/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
GRM2 Q14416 1/20 0.32
LTA4H P09960 1/20 0.32
EGLN2 Q96KS0 1/20 0.32

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
SCHEMBL2945343 0.93 UCHL1 (0.36) KDM4EUSP30PIM1PIM3PIM2
SCHEMBL7814732 0.74 KEAP1 (0.46) ALDH1A1
SCHEMBL7823337 0.74 KEAP1 (0.42) KDM4EALDH1A1
SCHEMBL4359875 0.73 AR (0.44) KDM4EALDH1A1USP30UCHL1
SCHEMBL1843566 0.73 KEAP1 (0.49) ALDH1A1PIM1
SCHEMBL3584707 0.72 ALOX15 (0.37) KDM4EALDH1A1NOTUM
SCHEMBL2530053 0.72 GRM2 (0.45) KDM4EALDH1A1NOTUMGRM2EGLN2
SCHEMBL6984223 0.71 ADRB1 (0.49) KDM4EALDH1A1PIM1PIM3PIM2
SCHEMBL7812796 0.69 FAAH (0.36) KDM4ENOTUM
SCHEMBL138181 0.68 KEAP1 (0.44) KDM4ENOTUM

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