SCHEMBL30331687

SCHEMBL30331687

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.49
▸ NPY1R P25929 9/20 0.49
▸ NPY5R Q15761 7/20 0.49
▸ NPY2R P49146 5/20 0.49
▸ GLP1R P43220 3/20 0.48
▸ SCTR P47872 1/20 0.48
▸ C5AR1 P21730 1/20 0.46
▸ IL23R Q5VWK5 1/20 0.45
▸ KLK7 P49862 1/20 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
SCHEMBL31688320 0.94 IL23R (0.50) NPY4RNPY1RNPY5RGLP1RSCTR
SCHEMBL30331172 0.91 IL23R (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL31064947 0.90 BACE1 (0.55) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29649781 0.90 AGTR2 (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL30592739 0.89 C5AR1 (0.55) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL31026560 0.89 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL7972955 0.87 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL7972947 0.87 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29701259 0.86 GLP1R (0.49) NPY4RNPY1RNPY5RNPY2RGLP1R
SCHEMBL29854592 0.86 GLP1R (0.57) GLP1RSCTR

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-112500451-B Peptide compound for repairing skin immunity and application thereof 中科南京绿色制造产业创新研究院 2023-04-14 — — CN claimed
CN-112500451-B Peptide compound for repairing skin immunity and application thereof 中科南京绿色制造产业创新研究院 2023-04-14 — — CN disclosed
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