SCHEMBL7149116

SCHEMBL7149116

CCOc1ccc(O)cc1[C@@H](O)CN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.50
ADRA1A P35348 1/20 0.50
TAAR1 Q96RJ0 2/20 0.44
NFKB1 P19838 2/20 0.44
HTR3A P46098 1/20 0.44
TSHR P16473 1/20 0.44
HIF1A Q16665 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALOX15 P16050 1/20 0.43
APEX1 P27695 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
CALM1 P0DP23 1/20 0.40
HSD17B10 Q99714 2/20 0.39
NPC1 O15118 1/20 0.39
USP2 O75604 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYSLTR2 Q9NS75 1/20 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
SCHEMBL7152543 0.86 TAAR1 (0.44) ADRA2AADRA1ATAAR1NFKB1HTR3A
SCHEMBL7151729 0.84 ADRA1A (0.70) ADRA2AADRA1ATAAR1NFKB1HTR3A
SCHEMBL7152597 0.83 ADRA1A (0.63) ADRA2AADRA1ATSHRKDM4ETDP1
SCHEMBL7149100 0.77 BLM (0.59) ADRA2AADRA1ATAAR1NFKB1HTR3A
SCHEMBL7149112 0.77 ALDH1A1 (0.52) ADRA2AADRA1AALOX15GAAMAPT
SCHEMBL7143077 0.76 NFKB1 (0.57) ADRA2AADRA1ATAAR1NFKB1HTR3A
SCHEMBL3026188 0.75 CALM1 (0.51) TSHRKDM4ECALM1HSD17B10MEN1
SCHEMBL8673547 0.74 HSD17B10 (0.61) KDM4ETDP1CALM1HSD17B10NPC1
SCHEMBL7143175 0.74 ADRA2A (0.56) ADRA2AADRA1ATAAR1NFKB1HTR3A
SCHEMBL1477520 0.74 PDE4A (0.49) CALM1MEN1KMT2ALTA4HGAA

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