SCHEMBL7148275

SCHEMBL7148275

COc1ccc(CC(C)NC[C@H](O)c2ccccc2O)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.51
ADRB3 P13945 2/20 0.51
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
ADRB2 P07550 15/20 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
SCHEMBL7148280 1.00 ADRB1 (0.51) ADRB1ADRB3ALOX15ALOX12ADRB2
SCHEMBL11088831 1.00 ADRB1 (0.51) ADRB1ADRB3ALOX15ALOX12ADRB2
Oxalic Acid SCHEMBL11079962 0.94 ADRB1 (0.54) ADRB1ADRB3ALOX15ALOX12ADRB2
SCHEMBL7152844 0.91 ADRB1 (0.54) ADRB1ADRB3ADRB2
SCHEMBL11088887 0.91 ADRB1 (0.54) ADRB1ADRB3ADRB2
SCHEMBL7152845 0.91 ADRB1 (0.54) ADRB1ADRB3ADRB2
Hydrochloric Acid SCHEMBL11084224 0.90 ADRB1 (0.53) ADRB1ADRB3ADRB2
SCHEMBL9816896 0.88 ADRB2 (0.48) ADRB1ADRB3ADRB2
SCHEMBL7146992 0.88 ADRB1 (0.51) ADRB1ADRB3ADRB2
SCHEMBL7146988 0.88 ADRB1 (0.51) ADRB1ADRB3ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030143701-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. 2003-07-31 US disclosed
EP-0924194-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2003-05-14 EP disclosed
US-6528686-B1 Reacting primary amine and ketone functionalized derivatives; catalytically reducing DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-03-04 US disclosed
EP-0924193-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2003-02-19 EP disclosed
EP-0939134-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2002-09-11 EP disclosed
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
EP-0654534-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2000-03-01 EP disclosed
EP-0939134-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-01 EP disclosed
EP-0924194-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
EP-0924193-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 EP disclosed
US-5629200-A MICROORGANISM DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1997-05-13 US disclosed
EP-0654534-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-24 EP disclosed