SCHEMBL7208889

SCHEMBL7208889

CCOc1cccc([C@@H](O)CN)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
ADRA2A P08913 2/20 0.42
ADRA1A P35348 2/20 0.42
ALOX15 P16050 2/20 0.41
KLK1 P06870 1/20 0.39
KLK5 Q9Y337 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
GLA P06280 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRA1B P35368 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.38
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
PLAT P00750 1/20 0.38
NFKB1 P19838 1/20 0.38
IGF1R P08069 1/20 0.38

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
SCHEMBL7145781 0.84 ADRA2A (0.56) ALDH1A1ADRA2AADRA1AALOX15NFKB1
SCHEMBL7149112 0.84 ALDH1A1 (0.52) ALDH1A1ADRA2AADRA1AALOX15GLA
SCHEMBL7145776 0.83 ALDH1A1 (0.43) ALDH1A1ADRA2AADRA1AALOX15GLA
SCHEMBL7150317 0.82 ALDH1A1 (0.46) ALDH1A1ADRA2AADRA1AALOX15GLA
SCHEMBL9460657 0.81 ALDH1A1 (0.44) ALDH1A1ALOX15KLK1KLK5GLA
SCHEMBL9206626 0.81 ALDH1A1 (0.44) ALDH1A1ALOX15KLK1KLK5GLA
SCHEMBL9967744 0.80 GABRA1 (0.59) ALDH1A1ALOX15GLAL3MBTL1IGF1R
SCHEMBL34021 0.80 BCHE (0.47) ALDH1A1ALOX15KLK1KLK5GLA
SCHEMBL7148817 0.80 ALDH1A1 (0.41) ALDH1A1ADRA2AADRA1AALOX15ADRA2B
SCHEMBL674008 0.79 ALDH1A1 (0.52) ALDH1A1ALOX15KLK1KLK5GLA

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
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-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