SCHEMBL7145488

SCHEMBL7145488

NC[C@H](O)c1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.43
ADRA1A P35348 4/20 0.43
ADRB2 P07550 3/20 0.43
ADRA2B P18089 3/20 0.43
ADRA2C P18825 3/20 0.43
CYP3A4 P08684 2/20 0.43
HSD17B10 Q99714 2/20 0.43
APEX1 P27695 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
MAPT P10636 3/20 0.42
RECQL P46063 3/20 0.42
BLM P54132 3/20 0.42
KDM4E B2RXH2 3/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TAAR1 Q96RJ0 3/20 0.39
HPGD P15428 3/20 0.39
ADRA1B P35368 2/20 0.39

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
SCHEMBL15811782 0.84 ADRB2 (0.59) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL7148243 0.79 CYP3A4 (0.48) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL7152846 0.78 TP53 (0.41) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL10396657 0.78 LMNA (0.53) ADRA2AADRA1AADRA2BADRA2CCYP3A4
SCHEMBL7147301 0.78 LMNA (0.53) ADRA2AADRA1AADRA2BADRA2CCYP3A4
SCHEMBL12438379 0.78 TP53 (0.41) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL7152584 0.76 ESR1 (0.62) ADRA2AADRA1AADRB2ADRA2BADRA2C
Hydrochloric Acid SCHEMBL2323324 0.76 TDP1 (0.40) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL9722631 0.74 CYP3A4 (0.36) ADRA2AADRA1AADRB2ADRA2BADRA2C
SCHEMBL7147236 0.73 RECQL (0.40) ADRA2AADRA1AADRB2ADRA2BADRA2C

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