SCHEMBL7149170

SCHEMBL7149170

COC(=O)C1(C(=O)OC)Oc2ccc(CC(C)=O)cc2O1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
POLB P06746 1/20 0.36
CYP3A4 P08684 2/20 0.36
ADRB2 P07550 3/20 0.35
ADRB3 P13945 3/20 0.35
ADRB1 P08588 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 4/20 0.34
ALPG P10696 1/20 0.34
ALOX15 P16050 3/20 0.34
HPGD P15428 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
GAA P10253 1/20 0.34

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
Butane SCHEMBL8713061 0.91 ADRB2 (0.37) SMN1; SMN2POLBCYP3A4ADRB2ADRB3
SCHEMBL7151283 0.90 SMN1; SMN2 (0.38) SMN1; SMN2CYP3A4ADRB2ADRB3ADRB1
SCHEMBL7150283 0.86 ALPG (0.41) SMN1; SMN2POLBCYP3A4HSD17B10ALDH1A1
SCHEMBL7151291 0.82 SMN1; SMN2 (0.37) SMN1; SMN2POLBCYP3A4ADRB2ADRB3
SCHEMBL7940556 0.80 ADRB2 (0.46) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A
SCHEMBL7937813 0.80 ADRB2 (0.46) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A
SCHEMBL7937815 0.80 ADRB2 (0.46) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A
SCHEMBL7929037 0.79 ADRB2 (0.43) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A
SCHEMBL7937841 0.79 ADRB2 (0.45) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A
SCHEMBL7929039 0.79 ADRB2 (0.43) SMN1; SMN2ADRB2ADRB3ADRB1ADRA2A

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 13 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-0924193-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-06-23 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
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US 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