SCHEMBL6327827

SCHEMBL6327827

CCN(CC)C(=O)c1ccccc1N(c1cccc(OC)c1)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 19/20 0.64
OPRM1 P35372 16/20 0.64
OPRK1 P41145 13/20 0.64
ACHE P22303 1/20 0.54

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
SCHEMBL5492915 0.86 OPRD1 (0.76) OPRD1OPRM1OPRK1
SCHEMBL5490000 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL5485781 0.83 OPRD1 (0.60) OPRD1OPRM1OPRK1
SCHEMBL7248855 0.81 OPRD1 (0.64) OPRD1OPRM1OPRK1
SCHEMBL6337054 0.79 OPRD1 (0.66) OPRD1OPRM1OPRK1
SCHEMBL6334466 0.78 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL6393279 0.78 OPRD1 (0.87) OPRD1OPRM1OPRK1
SCHEMBL6176767 0.77 OPRD1 (1.00) OPRD1OPRM1OPRK1
SCHEMBL6332701 0.76 OPRD1 (0.85) OPRD1OPRM1OPRK1
SCHEMBL6334645 0.76 OPRD1 (0.85) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6875777-B2 Compounds ASTRAZENECA AB (SE) 2005-04-05 US disclosed
EP-1242406-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed