SCHEMBL28358772

SCHEMBL28358772

N#Cc1c(N)cccc1OCC1CCCN(C(=O)O)C1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 4/20 0.40
IRAK4 Q9NWZ3 3/20 0.39
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
IKBKB O14920 1/20 0.36
TTR P02766 2/20 0.35
KMT2A Q03164 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL21113729 0.93 RBP4 (0.46) RBP4IRAK4TTRKMT2A
SCHEMBL621748 0.93 RBP4 (0.46) RBP4IRAK4TTRKMT2A
SCHEMBL15567544 0.87 IRAK4 (0.44) RBP4IRAK4HCRTR1KMT2ACHRNB2
SCHEMBL15567541 0.87 IRAK4 (0.44) RBP4IRAK4HCRTR1KMT2ACHRNB2
SCHEMBL619980 0.86 DCPS (0.41) RBP4IRAK4IKBKBKMT2A
SCHEMBL621414 0.86 ALDH1A1 (0.46) KMT2ACHRNB2CHRNA4
SCHEMBL15568256 0.86 IRAK4 (0.45) RBP4IRAK4HCRTR1
SCHEMBL621809 0.86 ALOX5AP (0.49) RBP4KMT2A
SCHEMBL15567002 0.86 IRAK4 (0.45) RBP4IRAK4HCRTR1
SCHEMBL15607279 0.86 ALOX5AP (0.49) RBP4KMT2A

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
CN-104603132-B Sweet taste modifier 弗门尼舍公司 2020-02-21 CN disclosed