SCHEMBL7058823

SCHEMBL7058823

Oc1ccc(C2CCC(NCC(O)c3cccc(Cl)c3)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 12/20 0.45
ADRB2 P07550 2/20 0.44
ADRB1 P08588 2/20 0.44

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
SCHEMBL7058826 1.00 ADRB3 (0.45) ADRB3ADRB2ADRB1
SCHEMBL7056462 0.93 ADRB3 (0.44) ADRB3ADRB2ADRB1
SCHEMBL8076934 0.93 ADRB3 (0.44) ADRB3ADRB2ADRB1
SCHEMBL7058117 0.90 ADRB3 (0.44) ADRB3ADRB2ADRB1
SCHEMBL7058116 0.90 ADRB3 (0.44) ADRB3ADRB2ADRB1
SCHEMBL7058816 0.87 ADRB3 (0.51) ADRB3ADRB1
Hydrochloric Acid SCHEMBL7051964 0.86 ADRB3 (0.50) ADRB3ADRB1
SCHEMBL7058084 0.84 ADRB3 (0.50) ADRB3ADRB1
SCHEMBL7058080 0.84 ADRB3 (0.49) ADRB3ADRB1
SCHEMBL4070956 0.84 ADRB3 (0.43) ADRB3ADRB1

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-0940387-B1 PHENYLETHANOLAMINE COMPOUNDS USEFUL AS BETA3 AGONIST, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATES IN THE PRODUCTION OF THE SAME MITSUBISHI PHARMA CORP (JP) 2003-05-07 EP disclosed
US-6069176-A PHENYLETHANOLAMINE COMPOUNDS WITH A BETA-3 ADRENERGIC RECEPTOR STIMULATING EFFECT, USE AS A THERAPY FOR URINARY INCONTINENCE MITSUBISHI-TOKYO PHARMACEUTICALS, INC. (JP) 2000-05-30 US disclosed
EP-0940387-A1 PHENYLETHANOLAMINE COMPOUNDS USEFUL AS BETA3 AGONIST, PROCESS FOR PRODUCING THE SAME, AND INTERMEDIATES IN THE PRODUCTION OF THE SAME TOKYO TANABE COMPANY LIMITED (JP) 1999-09-08 EP disclosed