SCHEMBL30069733

SCHEMBL30069733

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.54
▸ F2 P00734 1/20 0.46
▸ OPRD1 P41143 4/20 0.45
▸ ACE P12821 2/20 0.43
▸ NTSR2 O95665 2/20 0.42
▸ NTSR1 P30989 2/20 0.42
▸ GRB2 P62993 1/20 0.42
▸ CXCR4 P61073 1/20 0.40
▸ AGTR1 P30556 1/20 0.40
▸ AGTR2 P50052 1/20 0.40

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
SCHEMBL30286828 0.92 OPRM1 (0.52) OPRM1F2OPRD1ACENTSR2
SCHEMBL29886892 0.91 OPRM1 (0.47) OPRM1OPRD1
SCHEMBL30080797 0.90 OPRM1 (0.51) OPRM1F2OPRD1ACENTSR2
SCHEMBL20764559 0.90 OPRM1 (0.52) OPRM1F2OPRD1NTSR2NTSR1
SCHEMBL29591635 0.88 OPRM1 (0.52) OPRM1F2OPRD1ACENTSR2
SCHEMBL30434957 0.88 OPRM1 (0.57) OPRM1F2ACENTSR2NTSR1
SCHEMBL30435067 0.88 OPRM1 (0.55) OPRM1F2ACENTSR2NTSR1
SCHEMBL30723553 0.87 OPRM1 (0.53) OPRM1F2NTSR2NTSR1CXCR4
SCHEMBL30424443 0.87 F2 (0.50) OPRM1F2ACENTSR2NTSR1
SCHEMBL417518 0.86 OPRM1 (0.45) OPRM1NTSR2NTSR1CXCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4301858-A1 DOSING OF SIRNA COMPOUNDS TO THE CISTERNA MAGNA Alnylam Pharmaceuticals, Inc. (US) 2024-01-10 — — EP disclosed
WO-2022187617-A9 DOSING OF SIRNA COMPOUNDS TO THE CISTERNA MAGNA ALNYLAM PHARMACEUTICALS, INC. (US) 2023-08-31 — — WO disclosed
WO-2022187617-A1 DOSING OF SIRNA COMPOUNDS TO THE CISTERNA MAGNA ALNYLAM PHARMACEUTICALS, INC. (US) 2022-09-09 — — WO disclosed
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