SCHEMBL29780055

SCHEMBL29780055

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 16/20 0.64
▸ NPY1R P25929 10/20 0.64
▸ NPY5R Q15761 8/20 0.64
▸ NPY2R P49146 6/20 0.64
▸ KISS1R Q969F8 3/20 0.51

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
SCHEMBL31512205 1.00 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL31256959 1.00 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL31256973 0.97 NPY4R (0.67) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30202166 0.96 NPY4R (0.65) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29483775 0.94 NPY4R (0.71) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30804696 0.94 NPY4R (0.65) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31597002 0.94 NPY4R (0.55) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL23229948 0.94 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29531172 0.93 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30450301 0.93 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2RKISS1R

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-11376278-B2 Compositions and methods for treating disease SULFILATEC, INC. (US) 2022-07-05 — — US disclosed
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