SCHEMBL5368601

SCHEMBL5368601

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

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 12/20 0.48
▸ NPY1R P25929 7/20 0.48
▸ NPY2R P49146 5/20 0.48
▸ NPY5R Q15761 5/20 0.48
▸ KISS1R Q969F8 1/20 0.45
▸ CTSC P53634 1/20 0.43
▸ FNTA P49354 3/20 0.41
▸ FNTB P49356 3/20 0.41
▸ PGGT1B P53609 3/20 0.41
▸ ANPEP P15144 1/20 0.41
▸ RNPEP Q9H4A4 1/20 0.41
▸ DNPEP Q9ULA0 1/20 0.41

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
SCHEMBL4576035 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL1119077 0.97 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL5357516 0.97 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL1711701 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL29540393 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL5966594 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL5966602 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL1711691 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL7785244 0.88 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL7292029 0.88 GNPAT (0.52) NPY4RNPY1RNPY2RNPY5RKISS1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7164002-B2 FVIIa antagonists GENENTECH, INC. (US) 2007-01-16 — — US disclosed
US-20040087767-A1 FVIIa antagonists GENENTECH, INC. 2004-05-06 — — 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-20040087767-A1 FVIIa antagonists F13B, F5, TFPI NPY4R 1270/4885NPY1R 956/4885NPY2R 683/4885

“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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