SCHEMBL25627353

SCHEMBL25627353

NCCCCC(NC(O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CC(=O)O)NC(=O)CN)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CHRND Q07001 6/20 0.44
▸ CHRNA1 P02708 2/20 0.44
▸ CHRNG P07510 2/20 0.44
▸ CHRNB1 P11230 2/20 0.44
▸ NPY1R P25929 4/20 0.42
▸ NPY2R P49146 4/20 0.42
▸ NPY4R P50391 4/20 0.42
▸ NPY5R Q15761 4/20 0.42
▸ GRIA1 P42261 1/20 0.42
▸ PTPN1 P18031 2/20 0.41
▸ PTPN2 P17706 1/20 0.41
▸ PTPRA P18433 1/20 0.41
▸ PTPN6 P29350 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ GHSR Q92847 1/20 0.41
▸ SLC15A2 Q16348 1/20 0.41
▸ F2 P00734 1/20 0.41

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
SCHEMBL25627351 0.90 CHRND (0.50) CHRNDCHRNA1CHRNGCHRNB1NPY1R
SCHEMBL25627390 0.83 CHRND (0.50) CHRNDCHRNA1CHRNGCHRNB1NPY1R
SCHEMBL25627360 0.81 CHRND (0.48) CHRNDCHRNA1CHRNGCHRNB1NPY1R
SCHEMBL29476550 0.81 CHRNA1 (0.56) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25627092 0.80 PTPN1 (0.55) CHRNDCHRNA1CHRNGCHRNB1PTPN1
SCHEMBL28438258 0.80 CHRND (0.48) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL9318080 0.80 SLC15A2 (0.60) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL9318061 0.80 SLC15A2 (0.60) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25627368 0.79 OPRD1 (0.49) CHRNDCHRNA1CHRNGCHRNB1NPY1R
SCHEMBL7122844 0.79 SLC15A2 (0.59) CHRNDCHRNA1CHRNGCHRNB1NPY1R

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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