SCHEMBL27352129

SCHEMBL27352129

N=C(N)NCCCC(N)C(=O)NC(CCCNC(=N)N)C(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 12/20 0.47
NPY1R P25929 7/20 0.47
NPY2R P49146 5/20 0.47
NPY5R Q15761 5/20 0.47
EPHX1 P07099 2/20 0.42
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
TACR1 P25103 1/20 0.40
MC4R P32245 1/20 0.40
MC3R P41968 1/20 0.40
MC1R Q01726 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CMA1 P23946 1/20 0.39
LMNA P02545 1/20 0.39
HTR1E P28566 1/20 0.39

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
SCHEMBL8341764 1.00 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5REPHX1
SCHEMBL8338954 0.95 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5REPHX1
SCHEMBL29359776 0.91 EPHX1 (0.47) EPHX1DPP8DPP9DPP7MEN1
SCHEMBL2585866 0.91 EPHX1 (0.47) EPHX1DPP8DPP9DPP7MEN1
Pabetan SCHEMBL29894618 0.91 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5REPHX1
Pabetan SCHEMBL4546522 0.91 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5REPHX1
Pabetan SCHEMBL21571465 0.91 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5REPHX1
Pabetan SCHEMBL14928984 0.91 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5REPHX1
Hydrochloric Acid SCHEMBL4087778 0.90 EPHX1 (0.46) EPHX1DPP8DPP9DPP7MEN1
SCHEMBL8342382 0.88 MEN1 (0.43) NPY4RNPY1RNPY2RNPY5REPHX1

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-1060212-C Dictyostelium dipeptidylaminopeptidase LILLY CO ELI (US) 2001-01-03 CN disclosed
CN-1085253-A Dictyostelium dipeptidylaminopeptidase LILLY CO ELI (US) 1994-04-13 CN disclosed