SCHEMBL25627133

SCHEMBL25627133

CC(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccccc1)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 10/20 0.57
▸ OPRM1 P35372 5/20 0.57
▸ OPRK1 P41145 1/20 0.57
▸ CCKAR P32238 3/20 0.52
▸ CCKBR P32239 3/20 0.52
▸ PTPN1 P18031 2/20 0.51
▸ PTPN2 P17706 1/20 0.51
▸ PTPRA P18433 1/20 0.51
▸ PTPN6 P29350 1/20 0.51
▸ PTPN11 Q06124 1/20 0.51

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
SCHEMBL25627202 0.94 OPRD1 (0.57) OPRD1OPRM1OPRK1PTPN1PTPN2
SCHEMBL25627130 0.90 PTPN1 (0.52) OPRD1OPRM1OPRK1PTPN1PTPN2
SCHEMBL25627344 0.89 BACE1 (0.55) —
SCHEMBL25627368 0.88 OPRD1 (0.49) OPRD1CCKARCCKBR
SCHEMBL25627092 0.86 PTPN1 (0.55) PTPN1PTPN2PTPRAPTPN6PTPN11
SCHEMBL25626748 0.86 TACR3 (0.46) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL31238560 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1CCKARCCKBR
SCHEMBL22749409 0.84 OPRD1 (0.52) OPRD1OPRM1OPRK1
SCHEMBL22749410 0.84 OPRD1 (0.52) OPRD1OPRM1OPRK1
SCHEMBL25626031 0.84 ACE (0.59) OPRD1OPRM1OPRK1

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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