SCHEMBL16508517

SCHEMBL16508517

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

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 12/20 0.59
▸ NPY5R Q15761 8/20 0.59
▸ NPY1R P25929 7/20 0.59
▸ NPY2R P49146 5/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.44
▸ KISS1R Q969F8 1/20 0.43
▸ MAPK8 P45983 1/20 0.43
▸ MAPK9 P45984 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ GLP1R P43220 1/20 0.42
▸ GCGR P47871 1/20 0.42
▸ GIPR P48546 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
SCHEMBL16509117 0.96 NPY4R (0.57) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16508129 0.91 NPY4R (0.52) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16507937 0.90 RXFP1 (0.55) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16508090 0.89 NPY4R (0.58) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16508516 0.89 NPY4R (0.61) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16507855 0.88 RXFP1 (0.55) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16508478 0.88 NPY4R (0.60) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16507926 0.88 NPY4R (0.53) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16508993 0.88 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RRXFP1
SCHEMBL16509029 0.87 NPY4R (0.51) NPY4RNPY5RNPY1RNPY2RRXFP1

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-20110300167-A1 CXCR5 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. 2011-12-08 — — 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-20110300167-A1 CXCR5 RECEPTOR COMPOUNDS CXCR5, CXCR1, CCR5 NPY4R 789/4885NPY5R 173/4885NPY1R 467/4885

“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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