SCHEMBL38662780

SCHEMBL38662780

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 12/20 0.58
▸ OPRM1 P35372 3/20 0.58
▸ OPRD1 P41143 3/20 0.58
▸ OPRK1 P41145 2/20 0.58
▸ CTSB P07858 1/20 0.58

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
SCHEMBL30242956 0.89 BACE1 (0.60) CTSDOPRM1OPRD1OPRK1CTSB
SCHEMBL30272462 0.88 CTSD (0.59) CTSDCTSB
SCHEMBL30053045 0.88 CTSD (0.61) CTSD
SCHEMBL30904490 0.88 OPRM1 (0.61) CTSDOPRM1OPRD1OPRK1
SCHEMBL31707293 0.88 BACE1 (0.59) CTSDOPRM1OPRD1OPRK1CTSB
SCHEMBL29353596 0.87 OPRD1 (0.61) OPRM1OPRD1OPRK1CTSB
SCHEMBL7606417 0.87 OPRD1 (0.62) OPRM1OPRD1OPRK1CTSB
SCHEMBL7606425 0.87 OPRD1 (0.62) OPRM1OPRD1OPRK1CTSB
SCHEMBL19974075 0.87 OPRD1 (0.62) OPRM1OPRD1OPRK1CTSB
SCHEMBL2193357 0.87 OPRD1 (0.56) CTSDOPRM1OPRD1OPRK1

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
CN-108350035-B Cyclic polypeptides, methods for obtaining them and their use in therapy 埃克斯欧力提斯药物公司 2026-05-19 — — CN disclosed
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