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Sugi Predict / Compounds / SCHEMBL6887928

SCHEMBL6887928

SCHEMBL6887928

CC(C)C(NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)CNC(=O)C(Cc1ccc(O)cc1)NC(=O)CNC(=O)C(N)CS)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 10/20 0.55
▸ OPRM1 P35372 3/20 0.54
▸ NTSR1 P30989 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
SCHEMBL6887945 1.00 OPRD1 (0.55) OPRD1OPRM1NTSR1
SCHEMBL6889257 0.92 OPRD1 (0.54) OPRD1OPRM1NTSR1
SCHEMBL6889227 0.92 OPRD1 (0.54) OPRD1OPRM1NTSR1
SCHEMBL29583466 0.89 OPRD1 (0.64) OPRD1NTSR1
SCHEMBL29695588 0.88 OPRD1 (0.54) OPRD1
SCHEMBL29500565 0.88 OPRD1 (0.54) OPRD1
SCHEMBL30186556 0.85 CALCRL (0.55) OPRD1OPRM1
SCHEMBL29403705 0.85 IL23R (0.55) OPRD1
SCHEMBL29403763 0.84 OPRD1 (0.58) OPRD1OPRM1
SCHEMBL31688325 0.83 OPRD1 (0.53) OPRD1OPRM1NTSR1

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
EP-0708637-B1 SELF-ASSEMBLING POLYNUCLEOTIDE DELIVERY SYSTEM COMPRISING DENDRIMER POLYCATIONS UNIV CALIFORNIA (US) 2004-01-28 — — EP disclosed
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