SCHEMBL25627368

SCHEMBL25627368

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

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 4/20 0.49
▸ CCKAR P32238 3/20 0.49
▸ CCKBR P32239 3/20 0.49
▸ CHRND Q07001 6/20 0.48
▸ CHRNA1 P02708 2/20 0.48
▸ CHRNG P07510 2/20 0.48
▸ CHRNB1 P11230 2/20 0.48
▸ GRIA1 P42261 2/20 0.48
▸ IL23R Q5VWK5 2/20 0.48
▸ NPY1R P25929 3/20 0.47
▸ NPY2R P49146 3/20 0.47
▸ NPY4R P50391 3/20 0.47
▸ NPY5R Q15761 3/20 0.47
▸ TFPI P10646 1/20 0.47

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
SCHEMBL25627431 0.94 APC (0.52) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25627360 0.91 CHRND (0.48) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25627351 0.88 CHRND (0.50) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25627133 0.88 OPRD1 (0.57) OPRD1CCKARCCKBR
SCHEMBL29612042 0.85 NPY4R (0.56) NPY1RNPY2RNPY4RNPY5R
SCHEMBL29612183 0.84 BACE1 (0.57) OPRD1GRIA1IL23RTFPI
SCHEMBL29611501 0.82 BACE1 (0.58) OPRD1IL23RTFPI
SCHEMBL29611454 0.82 PTPN1 (0.60) OPRD1IL23R
SCHEMBL31114991 0.82 NPY4R (0.59) NPY1RNPY2RNPY4RNPY5R
SCHEMBL30547470 0.82 OPRD1 (0.54) OPRD1CCKARCCKBRCHRNDCHRNA1

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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