SCHEMBL31281099

SCHEMBL31281099

CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.58
▸ OPRD1 P41143 4/20 0.58
▸ NMUR2 Q9GZQ4 5/20 0.53
▸ NMUR1 Q9HB89 5/20 0.53
▸ F2 P00734 4/20 0.53
▸ KEAP1 Q14145 1/20 0.52
▸ CALCRL Q16602 1/20 0.51
▸ AKT1 P31749 1/20 0.50

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
SCHEMBL31281428 0.94 OPRM1 (0.60) OPRM1OPRD1NMUR2NMUR1F2
SCHEMBL31290242 0.86 OPRD1 (0.56) OPRM1OPRD1F2
SCHEMBL30560035 0.86 OPRD1 (0.56) OPRM1OPRD1F2
SCHEMBL30607393 0.86 CALCRL (0.59) OPRM1OPRD1KEAP1CALCRL
SCHEMBL30495622 0.86 OPRM1 (0.57) OPRM1OPRD1F2KEAP1CALCRL
SCHEMBL30678901 0.86 OPRM1 (0.54) OPRM1OPRD1CALCRLAKT1
SCHEMBL30176506 0.85 NPY2R (0.63) F2KEAP1
SCHEMBL30262152 0.84 MAPK8 (0.54) OPRD1KEAP1CALCRL
SCHEMBL30560036 0.84 OPRD1 (0.60) OPRM1OPRD1F2AKT1
SCHEMBL29599109 0.84 CALCR (0.54) F2CALCRL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4722227-A1 COMPLEX, PHARMACEUTICAL COMPOSITION, VACCINE, AND APPLICATIONS THEREOF ENU Pharma, Inc. (JP) 2026-04-08 — — EP disclosed
WO-2024241964-A1 COMPLEX, PHARMACEUTICAL COMPOSITION, VACCINE, AND APPLICATIONS THEREOF 遠友ファーマ株式会社 2024-11-28 — — WO disclosed
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