SCHEMBL22089844

SCHEMBL22089844

CC(C)CC(N)C(=O)NC(CCCNC(=N)N)C(=O)O.CCC(C)C(N)C(=O)NC(CCCNC(=N)N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.46
▸ NPY1R P25929 9/20 0.46
▸ NPY5R Q15761 8/20 0.46
▸ NPY2R P49146 5/20 0.46
▸ NOD1 Q9Y239 2/20 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
SCHEMBL15011349 0.92 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL9614927 0.92 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL27732271 0.92 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL27712094 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL7159410 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29492567 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29492562 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL7098633 0.91 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL31415951 0.90 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30111320 0.90 NPY4R (0.43) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3894863-A1 IN VITRO METHOD FOR DETECTING AVIAN INTESTINAL DYSBIOSIS Evonik Operations GmbH (DE) 2021-10-20 — — EP disclosed
WO-2020120376-A1 IN VITRO METHOD FOR DETECTING AVIAN INTESTINAL DYSBIOSIS EVONIK OPERATIONS GMBH (DE) 2020-06-18 — — WO disclosed
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