SCHEMBL7597310

SCHEMBL7597310

NCCC[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 8/20 0.52
NPY5R Q15761 4/20 0.52
CPB2 Q96IY4 1/20 0.50
MME P08473 1/20 0.49
CTSD P07339 1/20 0.49
NPY4R P50391 2/20 0.48
POLB P06746 1/20 0.47
NPFFR1 Q9GZQ6 2/20 0.47
NPFFR2 Q9Y5X5 2/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
GNPAT O15228 1/20 0.46

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
SCHEMBL8121995 1.00 NPY1R (0.52) NPY1RNPY5RCPB2MMECTSD
SCHEMBL7597314 1.00 NPY1R (0.52) NPY1RNPY5RCPB2MMECTSD
Hydrochloric Acid SCHEMBL9200911 0.98 NPY1R (0.51) NPY1RNPY5RCPB2MMECTSD
SCHEMBL8118883 0.95 CPB2 (0.55) NPY1RNPY5RCPB2MMECTSD
SCHEMBL9197461 0.95 CPB2 (0.55) NPY1RNPY5RCPB2MMECTSD
SCHEMBL8118882 0.95 CPB2 (0.55) NPY1RNPY5RCPB2MMECTSD
SCHEMBL8120862 0.90 NPY1R (0.54) NPY1RNPY5RCTSDNPY4RNPFFR1
SCHEMBL8526459 0.90 NPY1R (0.54) NPY1RNPY5RCTSDNPY4RNPFFR1
SCHEMBL9201260 0.87 NPY1R (0.55) NPY1RNPY5RCTSDNPY4RNPFFR1
SCHEMBL5313786 0.86 NPY1R (0.50) NPY1RNPY5RMMECTSDNPY4R

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
EP-3686183-B1 L-ORNITHINE PHENYL ACETATE AND METHODS OF MAKING THEREOF OCERA THERAPEUTICS INC (US) 2022-08-03 EP disclosed
EP-1017672-B1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2002-11-27 EP disclosed