SCHEMBL7150478

SCHEMBL7150478

CCOCc1cc([C@@H](O)CN)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 5/20 0.56
TDP1 Q9NUW8 5/20 0.56
KDM4E B2RXH2 4/20 0.56
ADRB2 P07550 4/20 0.56
MAPT P10636 3/20 0.56
RECQL P46063 3/20 0.56
APEX1 P27695 3/20 0.56
TAAR1 Q96RJ0 3/20 0.56
ADRB3 P13945 3/20 0.56
ADRB1 P08588 3/20 0.56
HPGD P15428 2/20 0.56
LMNA P02545 2/20 0.56
MAPK1 P28482 2/20 0.56
ADRA2A P08913 2/20 0.56
ADRA2B P18089 2/20 0.56
ADRA2C P18825 2/20 0.56
ADRA1D P25100 2/20 0.56
CYP3A4 P08684 2/20 0.56
MEN1 O00255 1/20 0.56
ADORA3 P0DMS8 1/20 0.56

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
SCHEMBL15061878 0.82 BLM (0.65) BLMTDP1KDM4EADRB2MAPT
SCHEMBL28576407 0.79 ADRB2 (0.69) BLMTDP1KDM4EADRB2ADRB1
SCHEMBL1310101 0.77 BLM (0.50) BLMTDP1KDM4EADRB2MAPT
SCHEMBL1310099 0.77 BLM (0.50) BLMTDP1KDM4EADRB2MAPT
SCHEMBL7152531 0.77 ADRB2 (0.67) BLMTDP1KDM4EADRB2MAPT
SCHEMBL2852257 0.77 ADRB2 (0.67) BLMTDP1KDM4EADRB2MAPT
SCHEMBL7151218 0.75 NFKB1 (0.71) BLMTDP1KDM4EADRB2MAPT
SCHEMBL249737 0.75 NFKB1 (0.71) BLMTDP1KDM4EADRB2MAPT
Hydrochloric Acid SCHEMBL75743 0.74 BLM (0.72) BLMTDP1KDM4EADRB2MAPT
SCHEMBL7761828 0.74 PRKCI (0.58) TDP1KDM4EMAPTRECQLHPGD

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-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