SCHEMBL11147609

SCHEMBL11147609

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

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 15/20 0.49
NPY1R P25929 9/20 0.49
NPY5R Q15761 8/20 0.49
NPY2R P49146 5/20 0.49
NOD1 Q9Y239 1/20 0.40
FOLH1 Q04609 1/20 0.39
ERAP2 Q6P179 1/20 0.39
ERAP1 Q9NZ08 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
NRP1 O14786 1/20 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
SCHEMBL9450543 1.00 NPY4R (0.49) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL31571445 0.98 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2R
SCHEMBL7098633 0.95 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL7159410 0.95 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL27712094 0.95 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29492567 0.95 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29492562 0.95 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL29649152 0.94 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30905098 0.94 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R
SCHEMBL32665651 0.94 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4418012-A Leucylalany-arginine derivative TORII & CO. LTD. (JP) 1983-11-29 US claimed
US-4418012-A Leucylalany-arginine derivative TORII & CO. LTD. (JP) 1983-11-29 US disclosed
US-4418012-A Leucylalany-arginine derivative TORII & CO. LTD. (JP) 1983-11-29 US disclosed