SCHEMBL1704057

SCHEMBL1704057

NCC(O)c1cc(O)c(O)cc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.65
ADRA2A P08913 3/20 0.65
ADRA2B P18089 3/20 0.65
ADRA2C P18825 3/20 0.65
ADRA1A P35348 3/20 0.65
CYP3A4 P08684 2/20 0.65
HSD17B10 Q99714 2/20 0.65
BLM P54132 5/20 0.63
MAPT P10636 4/20 0.63
RECQL P46063 4/20 0.63
TDP1 Q9NUW8 4/20 0.63
KDM4E B2RXH2 4/20 0.63
APEX1 P27695 3/20 0.63
RAD52 P43351 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
KDM4C Q9H3R0 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
TAAR1 Q96RJ0 3/20 0.54
HPGD P15428 2/20 0.54
ADRA1B P35368 2/20 0.54

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
SCHEMBL13158583 0.79 ADRA2A (1.00) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL1691820 0.79 ADRA2A (1.00) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL15811782 0.79 ADRB2 (0.59) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL21556945 0.79 ADRB2 (0.59) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL21556889 0.79 ADRB2 (0.59) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL2985234 0.78 LMNA (0.43) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL14138074 0.76 ADRB2 (0.55) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL7150196 0.75 TAAR1 (0.54) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL7149125 0.75 TAAR1 (0.54) ADRB2ADRA2AADRA2BADRA2CADRA1A
SCHEMBL6074838 0.75 TAAR1 (0.54) ADRB2ADRA2AADRA2BADRA2CADRA1A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10259894-B1 Oxygen permeable polymers, ionomers and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2019-04-16 US claimed
US-20190092882-A1 Oxygen Permeable Monomers, Polymers and Ionomers and Methods of Making the Same NISSAN MOTOR CO., LTD. (JP) 2019-03-28 US claimed
US-10259894-B1 Oxygen permeable polymers, ionomers and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2019-04-16 US disclosed
US-20190092882-A1 Oxygen Permeable Monomers, Polymers and Ionomers and Methods of Making the Same NISSAN MOTOR CO., LTD. (JP) 2019-03-28 US disclosed
EP-1695088-B1 METHOD FOR ANALYSING METABOLITES MAX PLANCK GESELLSCHAFT (DE) 2012-04-18 EP disclosed
US-20070141712-A1 Method for analysing metabolites MAX-PLANCK-GESSELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2007-06-21 US disclosed
EP-1695088-A1 METHOD FOR ANALYSING METABOLITES Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2006-08-30 EP disclosed
WO-2005059556-A1 METHOD FOR ANALYSING METABOLITES MAX PLANCK GESELLLSCHAFT ZUR FÖRDERUNG DER WISSENSCHAFTEN E.V. (DE) 2005-06-30 WO disclosed