SCHEMBL2945346

SCHEMBL2945346

N#CC1CCCN(C2COC(=O)N2c2ccccc2)C1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.32
USP30 Q70CQ3 1/20 0.32
NOTUM Q6P988 1/20 0.32
L3MBTL3 Q96JM7 2/20 0.31
MBTD1 Q05BQ5 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSK P43235 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PREP P48147 1/20 0.30
QPCT Q16769 1/20 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
SCHEMBL3014039 0.93 NOTUM (0.33) GRM5USP30NOTUMALDH1A1QPCT
SCHEMBL7823338 0.80 NOTUM (0.40) GRM5NOTUML3MBTL3MBTD1L3MBTL1
SCHEMBL7814733 0.80 ALDH1A1 (0.41) GRM5NOTUML3MBTL3MBTD1L3MBTL1
SCHEMBL1843567 0.79 ALDH1A1 (0.43) GRM5NOTUML3MBTL3MBTD1L3MBTL1
SCHEMBL6760968 0.78 NOTUM (0.34) GRM5NOTUM
SCHEMBL2724582 0.73 ALDH1A1 (0.38) GRM5NOTUML3MBTL3MBTD1L3MBTL1
SCHEMBL3573592 0.72 NOTUM (0.38) GRM5NOTUMALDH1A1TDP1QPCT
SCHEMBL3586944 0.72 ALDH1A1 (0.33) NOTUMALDH1A1QPCT
SCHEMBL28296440 0.72 NOTUM (0.33) NOTUMQPCT
SCHEMBL3260136 0.71 SIGMAR1 (0.42) NOTUMALDH1A1QPCT

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