SCHEMBL25627431

SCHEMBL25627431

CC(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CCCCN)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APC P25054 3/20 0.52
▸ TFPI P10646 1/20 0.51
▸ CHRND Q07001 5/20 0.50
▸ NPY4R P50391 3/20 0.50
▸ NPY1R P25929 2/20 0.50
▸ NPY2R P49146 2/20 0.50
▸ NPY5R Q15761 2/20 0.50
▸ CHRNA1 P02708 1/20 0.50
▸ CHRNG P07510 1/20 0.50
▸ CHRNB1 P11230 1/20 0.50
▸ IL23R Q5VWK5 1/20 0.49
▸ GRIA1 P42261 4/20 0.48

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
SCHEMBL25627368 0.94 OPRD1 (0.49) TFPICHRNDNPY4RNPY1RNPY2R
SCHEMBL25627390 0.89 CHRND (0.50) CHRNDNPY4RNPY1RNPY2RNPY5R
SCHEMBL13209217 0.87 IL23R (0.61) TFPIIL23R
SCHEMBL29611494 0.85 BACE1 (0.58) TFPIIL23RGRIA1
SCHEMBL30178189 0.85 LNPEP (0.51) NPY4RNPY1RNPY2RNPY5R
SCHEMBL25627360 0.84 CHRND (0.48) CHRNDNPY4RNPY1RNPY2RNPY5R
SCHEMBL31114991 0.83 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5R
Acetic Acid SCHEMBL29981808 0.83 LNPEP (0.53) —
SCHEMBL30099557 0.83 GNPAT (0.58) —
SCHEMBL29612060 0.82 BACE1 (0.59) TFPIIL23R

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
WO-2023106897-A1 NOVEL PEPTIDE DERIVATIVE DERIVED FROM ADIPONECTIN AND USE THEREOF 서울대학교병원 2023-06-15 — — WO disclosed
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