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Sugi Predict / Compounds / SCHEMBL30596157

SCHEMBL30596157

SCHEMBL30596157

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 2/20 0.51
▸ TFPI P10646 1/20 0.46
▸ IL23R Q5VWK5 1/20 0.46
▸ RAMP3 O60896 6/20 0.46
▸ CALCR P30988 6/20 0.46
▸ NPY4R P50391 5/20 0.45
▸ NPY1R P25929 4/20 0.45
▸ NPY2R P49146 4/20 0.45
▸ NPY5R Q15761 4/20 0.45
▸ RXFP1 Q9HBX9 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
SCHEMBL31344443 0.92 NPY4R (0.51) KEAP1NPY4RNPY1RNPY2RNPY5R
SCHEMBL31379768 0.92 NPY4R (0.51) KEAP1NPY4RNPY1RNPY2RNPY5R
SCHEMBL30262174 0.92 KEAP1 (0.52) KEAP1TFPIIL23RRAMP3CALCR
SCHEMBL31319515 0.91 RAMP3 (0.48) KEAP1TFPIRAMP3CALCRNPY4R
SCHEMBL9346849 0.91 RXFP1 (0.52) KEAP1TFPINPY4RNPY1RNPY2R
SCHEMBL9346837 0.91 RXFP1 (0.52) KEAP1TFPINPY4RNPY1RNPY2R
SCHEMBL31053731 0.90 KEAP1 (0.52) KEAP1RAMP3CALCRNPY4RNPY1R
SCHEMBL30544308 0.90 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30596211 0.90 NPY4R (0.46) KEAP1TFPIRAMP3CALCRNPY4R
SCHEMBL29736168 0.89 KEAP1 (0.47) KEAP1TFPIRAMP3CALCRNPY4R

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-116804045-B Polypeptide targeting HPV 16E 6 protein and preparation method and application thereof 东南大学 2025-11-07 — — CN disclosed
CN-116804045-A Polypeptide targeting HPV16E6 protein and preparation method and application thereof 东南大学 2023-09-26 — — CN disclosed
CN-116804045-A Polypeptide targeting HPV16E6 protein and preparation method and application thereof 东南大学 2023-09-26 — — CN disclosed
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