SCHEMBL16508475

SCHEMBL16508475

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 7/20 0.47
▸ NPY5R Q15761 6/20 0.47
▸ NPY1R P25929 5/20 0.47
▸ NPY2R P49146 3/20 0.47
▸ TLR2 O60603 1/20 0.43
▸ HASPIN Q8TF76 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ NOD1 Q9Y239 3/20 0.40
▸ IL23R Q5VWK5 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ NMT2 O60551 1/20 0.39
▸ NMT1 P30419 1/20 0.39
▸ KISS1R Q969F8 1/20 0.39

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
SCHEMBL16507902 0.95 NPY5R (0.43) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16507975 0.95 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16507940 0.92 GLP1R (0.46) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16508553 0.90 NPY4R (0.54) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16508577 0.89 NPY4R (0.53) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16507935 0.88 NPY5R (0.45) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16508507 0.88 CTSL (0.45) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL13356170 0.87 TLR2 (0.48) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16508481 0.87 TLR2 (0.52) NPY4RNPY5RNPY1RNPY2RTLR2
SCHEMBL16508517 0.87 NPY4R (0.59) 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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