SCHEMBL6554185

SCHEMBL6554185

O=C(O)c1c(S(=O)(=O)c2ccc(CCNC[C@H](O)c3cccc(Cl)c3)cc2)ccc(-c2ccccc2)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 20/20 0.60
ADRB1 P08588 16/20 0.60

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 SCHEMBL6553225 0.99 ADRB3 (0.59) ADRB3ADRB1
SCHEMBL6676357 0.91 ADRB3 (0.61) ADRB3ADRB1
SCHEMBL6681899 0.87 ADRB3 (0.71) ADRB3ADRB1
SCHEMBL6677186 0.82 ADRB3 (0.62) ADRB3ADRB1
SCHEMBL6554162 0.82 ADRB3 (0.39) ADRB3ADRB1
SCHEMBL6676716 0.81 ADRB3 (0.61) ADRB3ADRB1
Hydrochloric Acid SCHEMBL6541240 0.81 ADRB3 (0.79) ADRB3ADRB1
SCHEMBL6539727 0.81 ADRB3 (0.79) ADRB3ADRB1
Hydrochloric Acid SCHEMBL6541234 0.81 ADRB3 (0.79) ADRB3ADRB1
SCHEMBL6810135 0.80 ADRB3 (0.66) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO disclosed