SCHEMBL31588088

SCHEMBL31588088

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 3/20 0.49
▸ SCTR P47872 1/20 0.49
▸ NPY4R P50391 5/20 0.49
▸ NPY5R Q15761 5/20 0.49
▸ NPY1R P25929 4/20 0.49
▸ NPY2R P49146 2/20 0.49
▸ VIPR2 P41587 5/20 0.48
▸ VIPR1 P32241 3/20 0.48
▸ GCGR P47871 1/20 0.47

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
SCHEMBL15185952 0.88 VIPR2 (0.53) GLP1RVIPR2VIPR1
SCHEMBL30645283 0.87 GLP1R (0.47) GLP1RSCTRNPY4RNPY5RNPY1R
SCHEMBL30645276 0.87 GLP1R (0.48) GLP1RSCTRNPY4RNPY5RNPY1R
SCHEMBL30645277 0.87 GLP1R (0.48) GLP1RSCTRNPY4RNPY5RNPY1R
SCHEMBL30140911 0.87 GLP1R (0.51) GLP1RSCTRVIPR2VIPR1GCGR
SCHEMBL31232533 0.87 VIPR2 (0.51) GLP1RVIPR2VIPR1
SCHEMBL30645269 0.86 NPY4R (0.47) GLP1RSCTRNPY4RNPY5RNPY1R
SCHEMBL14479369 0.85 GLP1R (0.50) GLP1RSCTRNPY4RNPY5RNPY1R
SCHEMBL29542217 0.85 NPY4R (0.46) NPY4RNPY5RNPY1RNPY2RVIPR2
SCHEMBL31734741 0.85 NPY4R (0.58) NPY4RNPY5RNPY1RNPY2R

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-120025407-A Application of polypeptide HRH and analogues thereof in preparation of medicines for treating pulmonary fibrosis 川北医学院 2025-05-23 — — CN disclosed
CN-120025407-A Application of polypeptide HRH and analogues thereof in preparation of medicines for treating pulmonary fibrosis 川北医学院 2025-05-23 — — CN disclosed
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