SCHEMBL21579362

SCHEMBL21579362

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.43
▸ NPY1R P25929 9/20 0.43
▸ NPY5R Q15761 8/20 0.43
▸ NPY2R P49146 5/20 0.43
▸ PRSS1 P07477 2/20 0.41
▸ TMPRSS15 P98073 2/20 0.41
▸ NOD1 Q9Y239 1/20 0.40
▸ FOLH1 Q04609 2/20 0.40
▸ SIRT5 Q9NXA8 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
SCHEMBL13624778 0.93 FOLH1 (0.48) NPY4RNPY1RNPY5RNPY2RPRSS1
SCHEMBL30563225 0.90 NOD1 (0.51) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29473701 0.88 NPY4R (0.42) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL16731685 0.88 SIRT6 (0.43) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL18660499 0.86 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29779797 0.86 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30121059 0.86 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30120978 0.86 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29887603 0.86 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30544289 0.86 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RNOD1

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-20190352338-A1 INHIBITORS FOR PROTEIN N-TERMINAL METHYLTRANSFERASE AND USES THEREOF PURDUE RESEARCH FOUNDATION (US) 2019-11-21 — — 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-20190352338-A1 INHIBITORS FOR PROTEIN N-TERMINAL METHYLTRANSFERASE AND USES THEREOF GNMT, PRMT1, PRMT5 NPY4R 4627/4885NPY1R 4573/4885NPY5R 4354/4885

“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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