SCHEMBL7168920

SCHEMBL7168920

CCOC(OCC)[C@H](CC(C)C)N(C(=O)[C@@H](N)CCCNC(=N)N)S(=O)(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 12/20 0.35
NPY1R P25929 7/20 0.35
NPY2R P49146 5/20 0.35
NPY5R Q15761 5/20 0.35
EPHX2 P34913 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7167389 0.90 AVPR1B (0.35) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7166435 0.87 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7170495 0.84 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5REPHX2
SCHEMBL7171608 0.79 PLG (0.34) NPY4RNPY1R
SCHEMBL7168204 0.79 PLG (0.34) NPY4RNPY1R
SCHEMBL7166802 0.75 NPY4R (0.37) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7170068 0.74 NPY4R (0.35) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7170368 0.71 NPY4R (0.42) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7163853 0.70 PLG (0.34)
Hydrochloric Acid SCHEMBL11142424 0.69 PLAU (0.39) NPY4RNPY1RNPY2RNPY5RMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789578-B1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON INC (US) 2003-06-04 EP disclosed
EP-0789578-A4 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON INC (US) 2000-09-20 EP disclosed
EP-0789578-A1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON, INC. (US) 1997-08-20 EP disclosed
WO-1996014857-A1 MULTICATALYTIC PROTEASE INHIBITORS CEPHALON, INC. (US) 1996-05-23 WO disclosed