SCHEMBL7149089

SCHEMBL7149089

C[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(O)c(O)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 15/20 0.74
CASP3 P42574 1/20 0.74
CASP6 P55212 1/20 0.74
MAPT P10636 5/20 0.64
MAPK1 P28482 5/20 0.64
ADRB1 P08588 4/20 0.64
KDM4E B2RXH2 4/20 0.64
TDP1 Q9NUW8 4/20 0.64
TSHR P16473 4/20 0.64
HSD17B10 Q99714 4/20 0.64
CYP3A4 P08684 4/20 0.64
ADRB3 P13945 3/20 0.64
HIF1A Q16665 3/20 0.64
MTOR P42345 2/20 0.64
MEN1 O00255 2/20 0.64
LMNA P02545 2/20 0.64
CYP1A2 P05177 2/20 0.64
NFKB1 P19838 2/20 0.64
KMT2A Q03164 2/20 0.64
ADORA3 P0DMS8 2/20 0.64

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
SCHEMBL11807907 1.00 ADRB2 (0.74) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL7149088 1.00 ADRB2 (0.74) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL7147967 0.89 ADRB2 (0.67) ADRB2CASP3CASP6MAPK1ADRB1
SCHEMBL2455273 0.89 ADRB2 (0.78) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL29899656 0.89 ADRB2 (0.78) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL7154315 0.89 ADRB2 (0.68) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL7154320 0.89 ADRB2 (0.68) ADRB2CASP3CASP6MAPTMAPK1
SCHEMBL13754643 0.87 ADRB2 (0.72) ADRB2CASP3CASP6ADRB1TDP1
SCHEMBL7143882 0.87 ADRB2 (0.72) ADRB2CASP3CASP6ADRB1TDP1
SCHEMBL7143881 0.87 ADRB2 (0.72) ADRB2CASP3CASP6ADRB1TDP1

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