SCHEMBL5357516

SCHEMBL5357516

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.52
▸ NPY1R P25929 9/20 0.52
▸ NPY5R Q15761 8/20 0.52
▸ NPY2R P49146 5/20 0.52
▸ KISS1R Q969F8 1/20 0.47
▸ GNPAT O15228 1/20 0.45
▸ CTSL P07711 1/20 0.43

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
SCHEMBL1119077 1.00 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL4576035 0.97 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL5368601 0.97 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL6805280 0.90 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30692730 0.89 GNPAT (0.57) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29628174 0.89 GNPAT (0.57) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL10381527 0.89 GNPAT (0.57) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL23142771 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30051400 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30051461 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RKISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6168789-B1 COVALENTLY MODIFIED IN ITS CATALYTIC CENTER BY A PHE-PHE-ARG-CHLOROMETHYLKETONE ZYMOGENETICS, INC. 2001-01-02 — — US claimed
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
US-20040067889-A1 Stabilization of brain natriuretic peptide (BNP) in blood samples, methods and compositions related thereto BAYER CORPORATION 2004-04-08 — — US disclosed
EP-1378242-A1 Methods and compositions for the stabilization of brain natriuretic peptide (BNP) in blood samples BAYER CORPORATION (US) 2004-01-07 — — EP disclosed
US-20030087316-A1 Diagnostic markers of liver dysfunction HEMOSAGA DIAGNOSTICS CORPORATION 2003-05-08 — — US disclosed
WO-1994025581-A1 MODIFIED RECOMBINANT TISSUE PLASMINOGEN ACTIVATOR SOUTHERN SYDNEY AREA HEALTH SERVICE (AU) 1994-11-10 — — WO 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 956/4885NPY5R 569/4885

“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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