SCHEMBL2880909

SCHEMBL2880909

CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N([N+]=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.44
NPY1R P25929 6/20 0.44
NPY2R P49146 4/20 0.44
NPY5R Q15761 4/20 0.44
KISS1R Q969F8 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL5673367 0.89 KISS1R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL11302814 0.88 NPY4R (0.50) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL11302796 0.88 NPY4R (0.50) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL2876318 0.86 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL29732500 0.84 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL31412176 0.82 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL29540098 0.81 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL3295134 0.81 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL31314356 0.81 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30798743 0.81 NPY4R (0.60) NPY4RNPY1RNPY2RNPY5RSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8409840-B2 Recombinant preparation of selected bromelain fractions URSAPHARM ARZNEIMITTEL GMBH (DE) 2013-04-02 US disclosed
EP-2173868-B1 RECOMBINANT PREPARATION OF SELECTED BROMELAIN FRACTIONS URSAPHARM ARZNEIMITTEL GMBH (DE) 2012-10-17 EP disclosed
US-20100272659-A1 RECOMBINANT PREPARATION OF SELECTED BROMELAIN FRACTIONS URSAPHARM ARZNEIMITTEL GMBH (DE) 2010-10-28 US disclosed
EP-2173868-A1 RECOMBINANT PREPARATION OF SELECTED BROMELAIN FRACTIONS URSAPHARM Arzneimittel GmbH & Co. KG (DE) 2010-04-14 EP disclosed
WO-2009033536-A1 RECOMBINANT PREPARATION OF SELECTED BROMELAIN FRACTIONS URSAPHARM ARZNEIMITTEL GMBH & CO. KG (DE) 2009-03-19 WO disclosed
EP-2036978-A1 Recombinant preparation of selected bromelain fractions URSAPHARM Arzneimittel GmbH & Co. KG (DE) 2009-03-18 EP disclosed