SCHEMBL30213589

SCHEMBL30213589

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](CCCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 18/20 0.52
▸ NPY1R P25929 11/20 0.52
▸ NPY5R Q15761 10/20 0.52
▸ NPY2R P49146 7/20 0.52
▸ NMT2 O60551 1/20 0.42
▸ NMT1 P30419 1/20 0.42

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
SCHEMBL30371101 0.97 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL29872146 0.96 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29531964 0.93 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30988539 0.92 SLC15A2 (0.47) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL29978629 0.91 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31472996 0.90 SLC15A2 (0.50) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL31717990 0.89 SLC15A2 (0.51) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL31106970 0.89 SLC15A2 (0.51) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL30713830 0.89 SLC15A2 (0.51) NPY4RNPY1RNPY5RNPY2RNMT2
SCHEMBL30373028 0.89 SLC15A2 (0.51) NPY4RNPY1RNPY5RNPY2RNMT2

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-20230061116-A1 TARGETING PAR1 AND PAR2 TO REGULATE LIPID AND CHOLESTEROL ABUNDANCE MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2023-03-02 — — US disclosed
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