SCHEMBL29455717

SCHEMBL29455717

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

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 5/20 0.40
▸ NPY4R P50391 8/20 0.39
▸ NPY1R P25929 6/20 0.39
▸ NPY2R P49146 4/20 0.39
▸ NPY5R Q15761 4/20 0.39
▸ GNPAT O15228 1/20 0.39
▸ SIRT5 Q9NXA8 1/20 0.38
▸ FURIN P09958 2/20 0.38
▸ CTSD P07339 1/20 0.37
▸ BACE1 P56817 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
SCHEMBL29604474 0.96 ENPEP (0.44) ENPEPNPY4RGNPATFURIN
SCHEMBL30302903 0.92 NPY4R (0.43) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30945395 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL29732334 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL29732620 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL31110537 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30148469 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30302954 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30148440 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30302888 0.90 FURIN (0.42) NPY4RNPY1RNPY2RNPY5RFURIN

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-20220111126-A1 PREVENTING BIOLOGICAL TISSUE ADHESION 3-D MATRIX, LTD. (JP) 2022-04-14 — — US disclosed
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