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Sugi Predict / Compounds / SCHEMBL31612227

SCHEMBL31612227

SCHEMBL31612227

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ VIPR2 P41587 7/20 0.52
▸ VIPR1 P32241 6/20 0.52
▸ PTH1R Q03431 2/20 0.48
▸ GLP1R P43220 7/20 0.48
▸ KEAP1 Q14145 1/20 0.47
▸ MDM4 O15151 1/20 0.46
▸ MDM2 Q00987 1/20 0.46

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
SCHEMBL9126106 0.92 VIPR2 (0.45) VIPR2VIPR1GLP1R
SCHEMBL9126093 0.92 VIPR2 (0.45) VIPR2VIPR1GLP1R
SCHEMBL30262223 0.92 PTH1R (0.53) VIPR2VIPR1PTH1RKEAP1
SCHEMBL30432968 0.90 VIPR1 (0.59) VIPR2VIPR1GLP1R
SCHEMBL30432103 0.89 VIPR1 (0.62) VIPR2VIPR1PTH1RGLP1R
SCHEMBL30912049 0.89 GLP1R (0.53) VIPR2VIPR1GLP1R
SCHEMBL30512603 0.89 MC4R (0.47) VIPR2VIPR1GLP1R
SCHEMBL31567999 0.89 NPY4R (0.52) VIPR2VIPR1GLP1R
SCHEMBL31567997 0.89 NPY4R (0.52) VIPR2VIPR1GLP1R
SCHEMBL31612225 0.89 NPY4R (0.41) VIPR2VIPR1GLP1R

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-120118878-A AHL-lactonase high-thermal-stability mutant and application thereof in biological control of fruit tree fire blight 浙江工业大学 2025-06-10 — — CN claimed
CN-120118878-A AHL-lactonase high-thermal-stability mutant and application thereof in biological control of fruit tree fire blight 浙江工业大学 2025-06-10 — — CN disclosed
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