SCHEMBL7703130

SCHEMBL7703130

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

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.54
NPY1R P25929 6/20 0.54
NPY2R P49146 4/20 0.54
NPY5R Q15761 4/20 0.54
KEAP1 Q14145 1/20 0.45
FNTA P49354 3/20 0.45
FNTB P49356 3/20 0.45
PGGT1B P53609 3/20 0.45
BACE1 P56817 2/20 0.45
BACE2 Q9Y5Z0 1/20 0.45

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
SCHEMBL31412176 0.93 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL31345750 0.92 NPY4R (0.64) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29493332 0.92 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RKEAP1
SCHEMBL29540098 0.92 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL31415960 0.91 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL29531710 0.91 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL1737578 0.91 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL1737572 0.91 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL31184436 0.91 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL30903451 0.90 NPY4R (0.53) NPY4RNPY1RNPY2RNPY5RKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1223215-A1 TRANSFORMANT PRODUCING SECONDARY METABOLITE MODIFIED WITH FUNCTIONAL GROUP AND NOVEL BIOSYNTHESIS GENES MEIJI SEIKA KAISHA LTD. (JP) 2002-07-17 EP disclosed
EP-0081122-B1 CARRIER TRIPEPTIDES WITH ANTIFUNGAL ACTIVITY Helopharm W. Petrik GmbH & Co.KG. (DE) 1985-10-02 EP disclosed
EP-0081122-A1 Carrier tripeptides with antifungal activity Helopharm W. Petrik GmbH & Co.KG. (DE) 1983-06-15 EP disclosed