SCHEMBL23988965

SCHEMBL23988965

CC(C)C(=O)CC(N)CCCNC(=N)N

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 14/20 0.36
NPY1R P25929 9/20 0.36
NPY5R Q15761 8/20 0.36
NPY2R P49146 5/20 0.36
ALOX15 P16050 1/20 0.35
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DPP7 Q9UHL4 1/20 0.33
ITGB3 P05106 2/20 0.32
ITGA2B P08514 2/20 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
SCHEMBL23988668 0.83 ALOX15 (0.37) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL289167 0.81 ALOX15 (0.38) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL7250716 0.81 ALOX15 (0.38) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL7250717 0.81 ALOX15 (0.38) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL23988832 0.81 DPP7 (0.36) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL14421568 0.81 NPY4R (0.37) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL23489658 0.80 ITGB3 (0.34) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL13254058 0.80 ITGB3 (0.34) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL24932570 0.80 KISS1R (0.43)
SCHEMBL21973390 0.79 NPY4R (0.38) NPY4RNPY1RNPY5RNPY2RALOX15

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
WO-2021221656-A1 COMPOSITIONS AND METHODS OF USE THEREOF SYNEDGEN, INC. (US) 2021-11-04 WO disclosed