SCHEMBL25759551

SCHEMBL25759551

CC(C)CC(NC(=O)C(N)CCCNC(=N)N)C(=O)NC(CC(C)C)C(=O)NC(C)(CCCCCCCCCC[C@](C)(NC(=O)C(CO)NC(=O)C(C)NC(=O)c1ccccn1)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(=N)N)C(N)=O)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 14/20 0.45
▸ NPY1R P25929 9/20 0.45
▸ NPY5R Q15761 8/20 0.45
▸ NPY2R P49146 5/20 0.45
▸ KISS1R Q969F8 1/20 0.38

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
SCHEMBL24155349 1.00 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL25758506 0.98 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2R
SCHEMBL25758174 0.80 NPY5R (0.41) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL25759233 0.77 NPY5R (0.39) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL25758263 0.76 TFPI (0.40) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL25758366 0.76 NPY4R (0.37) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29947151 0.70 NPY4R (0.70) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29947137 0.70 NPY4R (0.70) NPY4RNPY1RNPY5RNPY2RKISS1R
Hydrochloric Acid SCHEMBL11139191 0.68 CTSK (0.45) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL31369288 0.68 NPY4R (0.62) 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-20230210939-A1 CYCLIC PEPTIDE COMPOUNDS AND METHODS OF USE VITEK, MICHAEL PETER 2023-07-06 — — 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-20230210939-A1 CYCLIC PEPTIDE COMPOUNDS AND METHODS OF USE VIP, NPPA, IAPP NPY4R 118/4885NPY1R 52/4885NPY5R 67/4885

“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.

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