SCHEMBL28637145

SCHEMBL28637145

NC(=O)OCCCC[C@H](NC(=O)[C@@H](N)Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.36
▸ OPRD1 P41143 1/20 0.34
▸ NOD1 Q9Y239 1/20 0.33
▸ NPY4R P50391 5/20 0.33
▸ EGFR P00533 1/20 0.32
▸ NPY1R P25929 3/20 0.32
▸ NPY2R P49146 2/20 0.32
▸ NPY5R Q15761 2/20 0.32
▸ SIRT5 Q9NXA8 1/20 0.31
▸ CTSS P25774 1/20 0.31

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
SCHEMBL28637147 1.00 CTSL (0.36) CTSLOPRD1NOD1NPY4REGFR
SCHEMBL31171952 0.84 NPY4R (0.50) CTSLNPY4REGFRNPY1RNPY2R
SCHEMBL22117392 0.81 SIRT5 (0.42) OPRD1NOD1NPY4REGFRNPY1R
SCHEMBL22117393 0.81 SIRT5 (0.42) OPRD1NOD1NPY4REGFRNPY1R
SCHEMBL28652456 0.80 CTSS (0.53) CTSLCTSS
SCHEMBL28652455 0.80 CTSS (0.53) CTSLCTSS
SCHEMBL28656951 0.80 CTSL (0.54) CTSL
SCHEMBL28656953 0.80 CTSL (0.54) CTSL
SCHEMBL28638723 0.79 NPY4R (0.43) NPY4RNPY1RNPY2RNPY5RSIRT5
SCHEMBL28638719 0.79 NPY4R (0.43) NPY4RNPY1RNPY2RNPY5RSIRT5

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-113544138-A Mitochondrial targeting peptides 隐形生物治疗公司 2021-10-22 — — CN disclosed
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