SCHEMBL7145434

SCHEMBL7145434

Cc1c([C@@H](O)CN)ccc(O)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.61
ADRA2B P18089 4/20 0.61
ADRA2C P18825 4/20 0.61
ADRA1A P35348 4/20 0.61
ADRB2 P07550 4/20 0.61
ADRA1B P35368 2/20 0.61
BLM P54132 4/20 0.46
MAPT P10636 3/20 0.46
APEX1 P27695 3/20 0.46
RECQL P46063 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
TAAR1 Q96RJ0 3/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 2/20 0.46
ADRB1 P08588 2/20 0.46
ADRB3 P13945 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
ADORA3 P0DMS8 1/20 0.46

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
SCHEMBL9767993 0.79 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL1461292 0.79 ADRA2A (0.68) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL29278698 0.78 ADRA2A (0.66) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL29374680 0.76 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL2250 0.76 ADRA2A (0.61) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL4122825 0.75 ADRB2 (0.50) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL213222 0.75 ADRA1A (0.40) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL7724551 0.74 ADRB2 (0.48) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL4869389 0.74 ADRB2 (0.48) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL15011592 0.74 LMNA (0.50) ADRA1AADRB2BLMHPGDCYP3A4

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