SCHEMBL7207154

SCHEMBL7207154

CC(Cc1ccc(-c2ccccc2)cc1)NCC(O)c1cccc(Cl)c1

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 14/20 0.81
ADRB1 P08588 11/20 0.81
SLC2A1 P11166 4/20 0.80
ADRB2 P07550 11/20 0.73
ADRA1D P25100 2/20 0.69
ADRA1A P35348 2/20 0.69
ADRA1B P35368 2/20 0.69
CYP2D6 P10635 2/20 0.69
CYP1A2 P05177 1/20 0.69
CYP2C9 P11712 1/20 0.69
CYP2C19 P33261 1/20 0.69
GLA P06280 1/20 0.65
ADRA2A P08913 1/20 0.64
ADRA2B P18089 1/20 0.64
ADRA2C P18825 1/20 0.64
CYP3A4 P08684 1/20 0.64
HIF1A Q16665 1/20 0.64

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
SCHEMBL7149376 1.00 ADRB3 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL7149375 1.00 ADRB3 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL9468401 0.94 SLC2A1 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL7150601 0.94 SLC2A1 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL7150600 0.94 SLC2A1 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL8305207 0.94 SLC2A1 (0.81) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL10433615 0.91 SLC2A1 (0.78) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL10433618 0.91 SLC2A1 (0.78) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL9468473 0.91 SLC2A1 (0.78) ADRB3ADRB1SLC2A1ADRB2ADRA1D
SCHEMBL10772479 0.90 SLC2A1 (0.83) ADRB3ADRB1SLC2A1ADRB2ADRA1D

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0924194-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2003-05-14 EP disclosed
US-5232946-A Promoting weight gain and reduction of blood sugar and fat deposits in animals, feed efficiency DR. KARL THOMAE GMBH (DE) 1993-08-03 US disclosed
EP-0400011-A1 NEW PHENYLETHANOLAMINES. BOEHRINGER INGELHEIM VETMED (DE) 1990-12-05 EP disclosed
EP-0375791-A1 Phenyl ethanol amines, their use as pharmaceutical compounds and as performance stimulants in animals, as well as processes for their preparation BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1990-07-04 EP disclosed
WO-1990006299-A1 NEW PHENYLETHANOLAMINES BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1990-06-14 WO disclosed