SCHEMBL29939649

SCHEMBL29939649

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

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.46
▸ NPY1R P25929 5/20 0.46
▸ NPY2R P49146 4/20 0.46
▸ NPY5R Q15761 4/20 0.46
▸ BACE1 P56817 6/20 0.44
▸ CTSD P07339 3/20 0.44
▸ TFPI P10646 1/20 0.42
▸ FURIN P09958 2/20 0.41

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
SCHEMBL30486089 0.95 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30378956 0.95 VIPR2 (0.45) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30887551 0.95 TFPI (0.45) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL10942123 0.94 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL10944182 0.94 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL10940273 0.94 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30486088 0.93 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL29506975 0.92 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30912352 0.92 IL23R (0.45) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31584722 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RBACE1

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
CN-115066254-A Human anti-inflammatory peptides for inhalation treatment of inflammatory lung diseases 阿德维塔生命科学有限责任公司 2022-09-16 — — CN disclosed
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