SCHEMBL31688352

SCHEMBL31688352

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.60
▸ OPRM1 P35372 2/20 0.60
▸ OPRK1 P41145 2/20 0.60
▸ KEAP1 Q14145 4/20 0.59
▸ NMUR2 Q9GZQ4 1/20 0.53
▸ NMUR1 Q9HB89 1/20 0.53

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
SCHEMBL31683251 0.92 OPRD1 (0.60) OPRD1OPRM1OPRK1KEAP1
SCHEMBL31688332 0.91 OPRM1 (0.61) OPRD1OPRM1OPRK1KEAP1
SCHEMBL31182911 0.90 CALCR (0.65) OPRD1OPRM1OPRK1
SCHEMBL30844085 0.89 KEAP1 (0.64) OPRD1OPRM1OPRK1KEAP1
SCHEMBL30906344 0.89 KEAP1 (0.59) KEAP1
SCHEMBL30262231 0.89 KEAP1 (0.60) OPRD1OPRM1OPRK1KEAP1
SCHEMBL31031489 0.88 CALCR (0.59) OPRD1OPRM1OPRK1KEAP1
SCHEMBL30906362 0.88 KEAP1 (0.57) OPRD1OPRM1OPRK1KEAP1
SCHEMBL31683752 0.88 KEAP1 (0.56) OPRD1OPRM1OPRK1KEAP1
SCHEMBL30906484 0.88 TFPI (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
US-20250297282-A1 VIRAL-BINDING PROTEIN AND RELATED REAGENTS, ARTICLES, AND METHODS OF USE JUNO THERAPEUTICS GMBH (DE) 2025-09-25 — — US disclosed
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