SCHEMBL19576166

SCHEMBL19576166

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.43
RNPEP Q9H4A4 2/20 0.43
DNPEP Q9ULA0 2/20 0.43
SCN9A Q15858 3/20 0.40
SLC7A5 Q01650 1/20 0.38
NPY4R P50391 6/20 0.38
NPY1R P25929 4/20 0.38
NPY2R P49146 2/20 0.38
NPY5R Q15761 2/20 0.38
DPP7 Q9UHL4 2/20 0.37
KISS1R Q969F8 1/20 0.37
MMP8 P22894 1/20 0.36
CACNA1B Q00975 1/20 0.35
RRM1 P23921 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
SCHEMBL29714926 0.84 FOLH1 (0.47) ANPEPRNPEPDNPEPSLC7A5NPY4R
SCHEMBL27903157 0.84 FOLH1 (0.47) ANPEPRNPEPDNPEPSLC7A5NPY4R
SCHEMBL1711582 0.84 FOLH1 (0.47) ANPEPRNPEPDNPEPSLC7A5NPY4R
SCHEMBL19576167 0.84 NPY4R (0.44) ANPEPRNPEPDNPEPNPY4RNPY1R
SCHEMBL20997125 0.82 NPY4R (0.41) ANPEPRNPEPDNPEPNPY4RNPY1R
SCHEMBL29714936 0.81 FOLH1 (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL29714940 0.80 FOLH1 (0.43) SLC7A5NPY4RNPY1RNPY2RNPY5R
SCHEMBL29423522 0.78 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R
SCHEMBL20997332 0.78 NPY4R (0.39) ANPEPRNPEPDNPEPNPY4RNPY1R
SCHEMBL29887149 0.78 BACE1 (0.43) NPY4RNPY1RNPY2RNPY5R

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-2017191579-A1 AMATOXIN DERIVATIVES AND CONJUGATES THEREOF AS INHIBITORS OF RNA POLYMERASE NOVARTIS AG (CH) 2017-11-09 WO disclosed