SCHEMBL31064839

SCHEMBL31064839

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

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 17/20 0.51
▸ NPY1R P25929 11/20 0.51
▸ NPY5R Q15761 10/20 0.51
▸ NPY2R P49146 7/20 0.48
▸ FOLH1 Q04609 1/20 0.38
▸ KISS1R Q969F8 1/20 0.37

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
SCHEMBL29978051 1.00 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL29774197 0.96 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL29388198 0.93 NPY4R (0.42) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30140870 0.91 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31257154 0.90 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL11569777 0.90 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL11567334 0.90 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31643173 0.90 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL11567327 0.90 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30685283 0.89 NPY4R (0.45) 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
CN-118581102-A Corn aspergillus flavus resistance gene ZmAFR, expression product, excellent haplotype and application thereof in corn breeding 河南农业大学 2024-09-03 — — CN disclosed
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