SCHEMBL7148283

SCHEMBL7148283

NC[C@H](O)c1cc(Br)cc(Br)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 5/20 0.47
TDP1 Q9NUW8 4/20 0.47
KDM4E B2RXH2 4/20 0.47
TAAR1 Q96RJ0 3/20 0.47
APEX1 P27695 3/20 0.47
MAPT P10636 3/20 0.47
RECQL P46063 3/20 0.47
ADRB2 P07550 3/20 0.47
ADRA2A P08913 3/20 0.47
ADRA2B P18089 3/20 0.47
ADRA2C P18825 3/20 0.47
HPGD P15428 2/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 2/20 0.47
ADRA1A P35348 2/20 0.47
CYP3A4 P08684 2/20 0.47
ADRB1 P08588 2/20 0.47
ADRA1D P25100 2/20 0.47
MEN1 O00255 1/20 0.47
ADORA3 P0DMS8 1/20 0.47

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
SCHEMBL30242726 0.86 APEX1 (0.40) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL24013091 0.86 APEX1 (0.40) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL7148229 0.79 BLM (0.45) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL1349340 0.79 PNMT (0.56) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL30846747 0.79 PNMT (0.56) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL610207 0.79 PNMT (0.56) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL7152113 0.79 PNMT (0.56) BLMTDP1KDM4ETAAR1APEX1
SCHEMBL7787305 0.78 CYP3A4 (0.31) TDP1LMNACYP3A4TSHR
Hydrochloric Acid SCHEMBL6533192 0.77 PNMT (0.54) BLMTDP1KDM4ETAAR1APEX1
Hydrochloric Acid SCHEMBL2065792 0.77 PNMT (0.54) BLMTDP1KDM4ETAAR1APEX1

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-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
EP-0654534-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-24 EP disclosed