SCHEMBL16181279

SCHEMBL16181279

CC(=N)c1ccc(CNC(=O)[C@H](CCCNC(=N)N)NC(=O)C(NC(=O)[C@H](CCCNC(=N)N)NC(=O)Cc2ccc(CNC(=N)N)cc2)C(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 5/20 0.48
▸ NPY4R P50391 13/20 0.45
▸ NPY1R P25929 9/20 0.45
▸ NPY5R Q15761 8/20 0.45
▸ NPY2R P49146 5/20 0.45

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
SCHEMBL16181274 0.96 NPY1R (0.51) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181272 0.96 FURIN (0.51) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181278 0.94 FURIN (0.54) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181269 0.92 FURIN (0.43) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181283 0.91 NPY4R (0.53) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181270 0.90 NPY4R (0.54) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181237 0.90 FURIN (0.52) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL7920067 0.90 FURIN (0.52) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181609 0.90 FURIN (0.52) FURINNPY4RNPY1RNPY5RNPY2R
SCHEMBL16181267 0.90 FURIN (0.52) FURINNPY4RNPY1RNPY5RNPY2R

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-8865865-B2 N-terminally modified tetrapeptide derivatives having a C-terminal arginine mimetic PHILIPPS-UNIVERSITAT MARBURG (DE) 2014-10-21 — — US disclosed
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