SCHEMBL3881745

SCHEMBL3881745

CC(=O)OOc1ccc2c(c1)C[C@@H](NC[C@H](O)c1cccc(Cl)c1)CC2

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 17/20 0.73
ADRB1 P08588 6/20 0.73

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
SCHEMBL10532036 0.87 ADRB3 (0.76) ADRB3ADRB1
SCHEMBL16666148 0.86 ADRB3 (0.80) ADRB3ADRB1
Hydrochloric Acid SCHEMBL9688056 0.86 ADRB3 (0.75) ADRB3ADRB1
SCHEMBL7561289 0.86 ADRB3 (0.73) ADRB3ADRB1
SCHEMBL4640095 0.86 ADRB3 (0.73) ADRB3ADRB1
SCHEMBL9361829 0.85 ADRB3 (0.78) ADRB3ADRB1
SCHEMBL9006798 0.85 ADRB3 (0.83) ADRB3ADRB1
SCHEMBL6441833 0.85 ADRB3 (0.83) ADRB3ADRB1
SCHEMBL3873178 0.84 ADRB3 (1.00) ADRB3ADRB1
SCHEMBL4640099 0.84 ADRB3 (1.00) 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
EP-1928448-B1 ASSOCIATION OF ß3 RECEPTOR AGONIST AND MONOAMINE REUPTAKE INHIBITORS, PHARMACEUTICAL COMPOSITION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2009-09-02 EP disclosed