SCHEMBL30904846

SCHEMBL30904846

CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.58
▸ NPY1R P25929 9/20 0.58
▸ NPY5R Q15761 8/20 0.58
▸ NPY2R P49146 5/20 0.54
▸ IL23R Q5VWK5 2/20 0.51
▸ NPBWR1 P48145 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
SCHEMBL30904844 0.98 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904848 0.97 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904843 0.95 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904849 0.94 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904842 0.93 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904847 0.92 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30904845 0.91 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL30343592 0.87 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2RIL23R
SCHEMBL29960067 0.86 NPY4R (0.62) NPY4RNPY1RNPY5RNPY2R
SCHEMBL31211751 0.85 TFPI (0.61) NPY4RNPY1RNPY5RNPY2RIL23R

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-117843726-A Immunosuppression polypeptide, preparation method thereof and application thereof in preparation of medicine for treating rheumatoid arthritis 河北科技大学 2024-04-09 — — CN disclosed
Send feedback