SCHEMBL29649727

SCHEMBL29649727

CC(C)[C@H](NC(=O)[C@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 16/20 0.65
▸ NPY1R P25929 10/20 0.65
▸ NPY5R Q15761 8/20 0.65
▸ NPY2R P49146 6/20 0.65
▸ OPRD1 P41143 1/20 0.46
▸ ACE P12821 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
SCHEMBL29649769 1.00 NPY4R (0.65) NPY4RNPY1RNPY5RNPY2ROPRD1
SCHEMBL30331385 0.95 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2ROPRD1
SCHEMBL31345750 0.93 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2ROPRD1
SCHEMBL4449035 0.93 NPY4R (0.74) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29559026 0.92 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2ROPRD1
SCHEMBL31412176 0.92 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2R
SCHEMBL3303678 0.92 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R
SCHEMBL3993177 0.92 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30392718 0.92 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R
SCHEMBL7248017 0.92 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11331368-B2 Angiotensin receptor agonists and uses thereof MONASH UNIVERSITY (AU) 2022-05-17 — — US disclosed
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