SCHEMBL8203790

SCHEMBL8203790

Cc1ccccc1CC(C)NCC(O)c1cccc(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.69
ADRB1 P08588 11/20 0.65
ADRB2 P07550 7/20 0.65
SLC2A1 P11166 2/20 0.65

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
SCHEMBL7152876 1.00 ADRB3 (0.69) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7152879 1.00 ADRB3 (0.69) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7148578 0.89 ADRB3 (0.67) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7148583 0.89 ADRB3 (0.67) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7143891 0.86 ADRB3 (0.52) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7143890 0.86 ADRB3 (0.52) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7149119 0.85 ADRB3 (0.54) ADRB3ADRB1ADRB2
SCHEMBL7149117 0.85 ADRB3 (0.54) ADRB3ADRB1ADRB2
SCHEMBL7152514 0.85 ADRB3 (0.52) ADRB3ADRB1ADRB2SLC2A1
SCHEMBL7152520 0.85 ADRB3 (0.52) ADRB3ADRB1ADRB2SLC2A1

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
US-6114582-A DECYCLIZATION TO FORM A CHEMICAL INTERMEDIATE FOR PRODUCING AN ANTI-OBESITY AGENT AND ANTIDIABETIC AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-05 US disclosed