SCHEMBL5049336

SCHEMBL5049336

C=COc1ccccc1C=NO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.62
MAPK1 P28482 2/20 0.62
TSHR P16473 2/20 0.62
HSD17B10 Q99714 1/20 0.62
ALDH1A1 P00352 4/20 0.58
LMNA P02545 6/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HTT P42858 4/20 0.51
MAPT P10636 3/20 0.50
USP2 O75604 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL8950411 0.78 HPGD (0.54) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL2331789 0.77 ALDH1A1 (0.44) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL23680002 0.77 HPGD (1.00) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL7856948 0.77 HPGD (1.00) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL23679903 0.77 HPGD (0.76) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL1155738 0.77 HPGD (1.00) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL7602964 0.76 HPGD (0.61) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL17275656 0.76 HPGD (0.61) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL2160891 0.76 HPGD (0.69) HPGDMAPK1TSHRHSD17B10ALDH1A1
SCHEMBL2420718 0.76 HPGD (0.69) HPGDMAPK1TSHRHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8597579-B1 Molecularly imprinted polymer-denuder based sensors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2013-12-03 US disclosed
US-20120164027-A1 Polymer Based Lanthanide Luminescent Sensors for the Detection of Organophosphorus Compounds MURRAY GEORGE M (US) 2012-06-28 US disclosed
US-7416703-B2 Polymer based lanthanide luminescent sensors for the detection of organophosphorus compounds THE JOHNS HOPKINS UNIVERSITY (US) 2008-08-26 US disclosed
US-20050019218-A1 Polymer based lanthanide luminescent sensors for the detection of organophosphorus compounds MURRAY GEORGE M (US) 2005-01-27 US disclosed
US-20040265178-A1 Molecularly imprinted polymer solution anion sensor MURRAY GEORGE M (US) 2004-12-30 US disclosed
EP-1436599-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR The Johns Hopkins University (US) 2004-07-14 EP disclosed
US-6749811-B2 QUANTITATIVE ANALYSIS; USING POLYMER BOUND TO RARE EARTH COMPOUND; WATER POLLUTION CONTROL THE JOHNS HOPKINS UNIVERSITY 2004-06-15 US disclosed
US-20030129092-A1 Molecularly imprinted polymer solution anion sensor JOHN HOPKINS UNIVERSITY, THE 2003-07-10 US disclosed
WO-2003034043-A2 MOLECULARLY IMPRINTED POLYMER SOLUTION ANION SENSOR THE JOHNS HOPKINS UNIVERSTIY (US) 2003-04-24 WO disclosed
US-20030003587-A1 Molecularly imprinted polymer based sensors for the detection of narcotics JOHNS HOPKINS UNIVERSITY, THE 2003-01-02 US disclosed
WO-2001077672-A2 MOLECULARLY IMPRINTED POLYMER BASED SENSORS FOR THE DETECTION OF NARCOTICS THE JOHNS HOPKINS UNIVERSITY (US) 2001-10-18 WO disclosed