SCHEMBL29826005

SCHEMBL29826005

N=C(N)NCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.55
NPY1R P25929 6/20 0.55
NPY2R P49146 4/20 0.55
NPY5R Q15761 4/20 0.55
NAALAD2 Q9Y3Q0 1/20 0.53
FOLH1 Q04609 2/20 0.52
GNPAT O15228 1/20 0.48
BACE1 P56817 1/20 0.47
FNTA P49354 3/20 0.46
FNTB P49356 3/20 0.46
PGGT1B P53609 3/20 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
SCHEMBL30903447 0.98 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RNAALAD2
SCHEMBL30770172 0.96 NPY4R (0.55) NPY4RNPY1RNPY2RNPY5RNAALAD2
SCHEMBL30866936 0.96 NPY4R (0.55) NPY4RNPY1RNPY2RNPY5RNAALAD2
SCHEMBL31410842 0.94 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5RNAALAD2
SCHEMBL4048021 0.94 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL29577090 0.94 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL31184527 0.94 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL4048028 0.94 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL31356561 0.94 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL31190179 0.93 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNAALAD2

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-20220273830-A1 COMPOUNDS AND METHODS OF USE Edinburgh Molecular Imaging Limited (GB) 2022-09-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220273830-A1 COMPOUNDS AND METHODS OF USE VIP, QPCT, CALCRL NPY4R 888/4885NPY1R 590/4885NPY2R 816/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.