SCHEMBL7150504

SCHEMBL7150504

NC[C@H](O)c1cc(I)ccc1I

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
ADRA2A P08913 4/20 0.38
ADRA1A P35348 4/20 0.38
MAPT P10636 3/20 0.38
RECQL P46063 3/20 0.38
BLM P54132 3/20 0.38
TAAR1 Q96RJ0 3/20 0.38
ADRB2 P07550 3/20 0.38
ADRA2B P18089 3/20 0.38
ADRA2C P18825 3/20 0.38
KDM4E B2RXH2 3/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
ADRA1B P35368 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
ADRB1 P08588 1/20 0.38
ADORA3 P0DMS8 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
SCHEMBL7151317 0.83 ADRA2A (0.40) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7152574 0.76 ADRA2A (0.42) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7152837 0.75 ADRA2A (0.38) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7150299 0.74 IDO1 (0.42) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL10595562 0.74 IDO1 (0.42) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL21556945 0.72 ADRB2 (0.59) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7147408 0.72 ADRA2A (0.41) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7148764 0.71 TAAR1 (0.64) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7146314 0.71 BLM (0.57) APEX1TDP1ADRA2AADRA1AMAPT
SCHEMBL7150207 0.70 TTR (0.39) APEX1TDP1ADRA2AADRA1AMAPT

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-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
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