SCHEMBL11094153

SCHEMBL11094153

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

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
NPY4R P50391 13/20 0.41
NPY1R P25929 9/20 0.41
NPY5R Q15761 8/20 0.41
NPY2R P49146 5/20 0.41
FURIN P09958 2/20 0.41
PCSK6 P29122 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
SCHEMBL3308386 0.94 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30643187 0.94 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30132822 0.93 SMN1; SMN2 (0.48) SMN1; SMN2NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL13933715 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL583830 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL11021602 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL4669504 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL11596919 0.91 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
SCHEMBL16316642 0.87 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL25361 0.87 NPY4R (0.51) 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-0100673-A2 A method of enhancing neurofiber regrowth THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1984-02-15 EP disclosed