SCHEMBL13707237

SCHEMBL13707237

COc1cc([N+](=O)[O-])ccc1N/N=C(/C(C)=O)C(=O)Nc1ccccc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.57
HTT P42858 1/20 0.57
ALDH1A1 P00352 6/20 0.56
MAPT P10636 4/20 0.56
MAPK1 P28482 1/20 0.56
GAA P10253 2/20 0.56
LMNA P02545 2/20 0.54
KCNMA1 Q12791 1/20 0.54
EPHX1 P07099 2/20 0.54
RORC P51449 1/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
GLA P06280 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RECQL P46063 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL765695 0.91 GAA (0.52) PKMHTTALDH1A1MAPTMAPK1
SCHEMBL12299506 0.90 CRHBP (0.53) PKMHTTALDH1A1MAPTMAPK1
SCHEMBL15244989 0.86 ALDH1A1 (0.56) PKMHTTALDH1A1MAPTGAA
SCHEMBL12998507 0.85 GAA (0.47) PKMHTTALDH1A1MAPTMAPK1
SCHEMBL12638062 0.83 ALDH1A1 (0.48) PKMHTTALDH1A1MAPTLMNA
SCHEMBL1880156 0.83 ALDH1A1 (0.48) PKMHTTALDH1A1MAPTLMNA
SCHEMBL1880162 0.83 ALDH1A1 (0.48) PKMHTTALDH1A1MAPTLMNA
SCHEMBL12299501 0.82 MAPT (0.54) PKMHTTALDH1A1MAPTMAPK1
SCHEMBL12299509 0.82 ALDH1A1 (0.54) PKMHTTALDH1A1MAPTMAPK1
SCHEMBL12299507 0.82 ALDH1A1 (0.67) PKMHTTALDH1A1MAPTMAPK1

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-20220011688-A1 ELECTROSTATIC INK COMPOSITION HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-01-13 US disclosed
WO-2021061162-A1 ELECTROSTATIC INK COMPOSITION HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-04-01 WO disclosed
US-10907056-B2 Curable compositions BLUE CUBE IP LLC (US) 2021-02-02 US disclosed
US-20180100076-A1 CURABLE COMPOSITIONS DOW GLOBAL TECHNOLOGIES LLC 2018-04-12 US disclosed
US-20180100076-A1 CURABLE COMPOSITIONS DOW GLOBAL TECHNOLOGIES LLC 2018-04-12 US disclosed
WO-2016153894-A1 CURABLE COMPOSITIONS BLUE CUBE IP LLC (US) 2016-09-29 WO disclosed
US-7582150-B2 Pigment dispersions with polymeric dispersants having pending chromophore groups AGFA GRAPHICS NV (BE) 2009-09-01 US disclosed
US-20080207806-A1 Pigment Dispersions with Polymeric Dispersants Having Pending Chromophore Groups AGFA GRAPHICS NV (BE) 2008-08-28 US disclosed