SCHEMBL27732271

SCHEMBL27732271

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

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.40
▸ NPY1R P25929 7/20 0.40
▸ NPY2R P49146 5/20 0.40
▸ NPY5R Q15761 5/20 0.40
▸ NOD1 Q9Y239 3/20 0.40
▸ ENPEP Q07075 7/20 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
SCHEMBL15011349 1.00 NPY4R (0.40) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL9614927 1.00 NPY4R (0.40) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30111320 0.97 NPY4R (0.43) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL31265334 0.95 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30484000 0.94 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL31318675 0.94 ENPEP (0.47) ENPEP
SCHEMBL19554383 0.94 NPY4R (0.39) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL31410877 0.93 ENPEP (0.40) NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL31206444 0.93 ENPEP (0.47) NPY4RNPY1RNPY2RNPY5RENPEP
Trifluoroacetic Acid SCHEMBL7445661 0.93 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RNOD1

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
CN-101184510-A Methods of treating various disorders by administering sustained release L-arginine ENOS PHARMACEUTICALS INC (US) 2008-05-21 — — CN disclosed
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