SCHEMBL13769032

SCHEMBL13769032

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

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 14/20 0.36
NPY1R P25929 9/20 0.36
NPY5R Q15761 8/20 0.36
NPY2R P49146 5/20 0.36
ALOX15 P16050 1/20 0.35
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CACNA1B Q00975 2/20 0.34

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
SCHEMBL15478607 1.00 NPY4R (0.36) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL14632143 1.00 NPY4R (0.36) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL26466762 0.90 ANPEP (0.30) ALOX15
SCHEMBL24172621 0.87 C3AR1 (0.36) MEN1KMT2ACACNA1B
SCHEMBL7602596 0.86 NPY4R (0.38) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL14599990 0.86 NPY4R (0.38) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL1388278 0.85 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL8120411 0.85 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL26429269 0.85 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2RALOX15
SCHEMBL23106038 0.84 NPY4R (0.39) NPY4RNPY1RNPY5RNPY2R

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
EP-1401473-B1 TRANSPORTERS COMPRISING SPACED ARGININE MOIETIES CELLGATE INC (US) 2009-07-29 EP disclosed