SCHEMBL6593489

SCHEMBL6593489

CC(C)(C)OC(=O)N(C[C@@H](O)c1cccc(Cl)c1)[C@H]1CCc2ccc(-c3ccc(C(=O)O)s3)cc2C1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.63
ADRB1 P08588 6/20 0.48

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
SCHEMBL6593486 1.00 ADRB3 (0.63) ADRB3ADRB1
SCHEMBL6135045 0.87 ADRB3 (0.60) ADRB3ADRB1
SCHEMBL6135047 0.87 ADRB3 (0.60) ADRB3ADRB1
SCHEMBL6588709 0.86 ADRB3 (0.49) ADRB3ADRB1
SCHEMBL6588714 0.86 ADRB3 (0.49) ADRB3ADRB1
SCHEMBL9436806 0.85 ADRB3 (0.43) ADRB3ADRB1
SCHEMBL6133817 0.85 ADRB3 (0.43) ADRB3ADRB1
SCHEMBL9318252 0.85 ADRB3 (0.43) ADRB3ADRB1
SCHEMBL6133819 0.85 ADRB3 (0.43) ADRB3ADRB1
SCHEMBL6134862 0.85 ADRB3 (0.54) 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-1483236-A1 AMINOALCOHOL DERIVATIVES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-08 EP disclosed
WO-2003076397-A1 AMINOALCOHOL DERIVATIVES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-09-18 WO disclosed