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SCHEMBL30368024

SCHEMBL30368024

N=C(N)NCCC[C@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 18/20 0.63
▸ NPY1R P25929 11/20 0.63
▸ NPY5R Q15761 9/20 0.63
▸ NPY2R P49146 7/20 0.63

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
SCHEMBL30368148 1.00 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30368147 0.99 NPY4R (0.62) NPY4RNPY1RNPY5RNPY2R
SCHEMBL32672584 0.98 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30361669 0.98 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30368081 0.97 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30361666 0.97 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30367902 0.96 NPY4R (0.57) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30368132 0.96 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30367838 0.96 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30368227 0.95 NPY4R (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115989236-A Antimicrobial peptidomimetics 斯派西斯公司 2023-04-18 — — CN claimed
CN-115989236-A Antimicrobial peptidomimetics 斯派西斯公司 2023-04-18 — — CN disclosed