SCHEMBL6681899

SCHEMBL6681899

O=C(O)c1ccc(-c2ccccc2)c(S(=O)(=O)c2ccc(CCNCC(O)c3cccc(Cl)c3)cc2)c1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 20/20 0.71
ADRB1 P08588 16/20 0.71

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
Hydrochloric Acid SCHEMBL6554197 0.88 ADRB3 (0.86) ADRB3ADRB1
Hydrochloric Acid SCHEMBL6541240 0.87 ADRB3 (0.79) ADRB3ADRB1
SCHEMBL6539727 0.87 ADRB3 (0.79) ADRB3ADRB1
Hydrochloric Acid SCHEMBL6541234 0.87 ADRB3 (0.79) ADRB3ADRB1
SCHEMBL6554185 0.87 ADRB3 (0.60) ADRB3ADRB1
SCHEMBL6676357 0.87 ADRB3 (0.61) ADRB3ADRB1
SCHEMBL6805829 0.86 ADRB3 (0.71) ADRB3ADRB1
Hydrochloric Acid SCHEMBL6553225 0.86 ADRB3 (0.59) ADRB3ADRB1
SCHEMBL6805824 0.86 ADRB3 (0.71) ADRB3ADRB1
SCHEMBL6803914 0.86 ADRB3 (0.79) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004045610-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2004-06-03 WO disclosed