SCHEMBL29973095

SCHEMBL29973095

CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.57
IL23R Q5VWK5 1/20 0.55
CCKBR P32239 2/20 0.53
CCKAR P32238 1/20 0.52
NPY1R P25929 1/20 0.52
NPY2R P49146 1/20 0.52
NPY4R P50391 1/20 0.52
GLP1R P43220 1/20 0.51
GCGR P47871 1/20 0.51
GIPR P48546 1/20 0.51

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
SCHEMBL31232428 0.97 GHSR (0.52) GHSRIL23RCCKBRNPY1RNPY2R
SCHEMBL29419958 0.94 GHSR (0.61) GHSRNPY1RNPY2RNPY4R
SCHEMBL24172454 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL19731216 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL16692899 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL19731206 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL16692892 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL16692898 0.93 IL23R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL19731215 0.92 GLP1R (0.61) GHSRIL23RNPY2RGLP1RGCGR
SCHEMBL31661149 0.92 GHSR (0.61) GHSR

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
EP-4067370-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS Yu, Chongxi (US) 2022-10-05 EP disclosed