SCHEMBL11567334

SCHEMBL11567334

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

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.47
▸ NPY1R P25929 9/20 0.47
▸ NPY5R Q15761 8/20 0.47
▸ NPY2R P49146 5/20 0.47
▸ BACE1 P56817 3/20 0.39
▸ CTSD P07339 1/20 0.39
▸ BACE2 Q9Y5Z0 1/20 0.37

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
SCHEMBL31643173 1.00 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RBACE1
SCHEMBL11567327 1.00 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RBACE1
SCHEMBL11569777 1.00 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RBACE1
SCHEMBL29774197 0.94 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29658786 0.94 FURIN (0.38) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30988493 0.91 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30085019 0.91 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RCTSD
SCHEMBL31064839 0.90 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29978051 0.90 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30140870 0.89 NPY4R (0.47) 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
US-4146614-A TREATMENT OF SCHIZOPHRENIA STATE OF MICHIGAN (US) 1979-03-27 — — US disclosed
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