SCHEMBL31479945

SCHEMBL31479945

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

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.48
NPY1R P25929 6/20 0.48
NPY2R P49146 4/20 0.48
NPY5R Q15761 4/20 0.48
GNPAT O15228 1/20 0.48
NOD1 Q9Y239 3/20 0.41
SIRT5 Q9NXA8 1/20 0.38
FOLH1 Q04609 1/20 0.38

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
SCHEMBL30099484 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099629 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099714 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099491 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099502 1.00 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL29628247 0.99 GNPAT (0.49) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30798042 0.99 GNPAT (0.49) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099449 0.97 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099691 0.97 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT
SCHEMBL30099575 0.97 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RGNPAT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 US claimed
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 US disclosed