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SCHEMBL30237703

SCHEMBL30237703

CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 14/20 0.54
▸ NPY1R P25929 9/20 0.54
▸ NPY5R Q15761 8/20 0.54
▸ NPY2R P49146 5/20 0.54
▸ GLP1R P43220 4/20 0.50
▸ SCTR P47872 1/20 0.50
▸ KISS1R Q969F8 1/20 0.49

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
SCHEMBL10439118 0.92 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL10439117 0.92 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29376517 0.90 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29684563 0.90 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL30543172 0.89 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29581619 0.88 KISS1R (0.57) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL31332245 0.88 NPY4R (0.55) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29797055 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29519822 0.87 GLP1R (0.52) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL7972955 0.87 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113150071-B Marine brevibacillus brevis antitumor active polypeptide and medicine and application thereof 上海健康医学院 2023-02-17 — — CN claimed
CN-113150071-B Marine brevibacillus brevis antitumor active polypeptide and medicine and application thereof 上海健康医学院 2023-02-17 — — CN disclosed
CN-113150071-B Marine brevibacillus brevis antitumor active polypeptide and medicine and application thereof 上海健康医学院 2023-02-17 — — CN disclosed
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