SCHEMBL17323481

SCHEMBL17323481

O=[N+]([O-])c1ccc(OCCn2cccc2)c([N+](=O)[O-])c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
LMNA P02545 4/20 0.48
AGTR1 P30556 1/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
PKM P14618 2/20 0.47
HSPB1 P04792 3/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
PRSS1 P07477 1/20 0.43

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
SCHEMBL7907585 0.83 NPC1 (0.59) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL17826563 0.83 ALDH1A1 (0.68) ALDH1A1LMNAKMT2AKDM4EPKM
SCHEMBL11221739 0.82 MAPT (0.56) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL16922787 0.81 ALDH1A1 (0.43) ALDH1A1LMNAAGTR1MEN1KMT2A
SCHEMBL15567163 0.80 LTA4H (0.60) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL28490932 0.79 ALDH1A1 (0.76) ALDH1A1LMNAAGTR1MEN1KMT2A
SCHEMBL3167372 0.79 HSPB1 (0.43) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL4101417 0.78 TSHR (0.59) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL6575773 0.78 MEN1 (0.56) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL8973132 0.78 CYP19A1 (0.57) ALDH1A1LMNAMEN1KMT2AMAPT

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-9644147-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2017-05-09 US disclosed
US-9644147-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2017-05-09 US disclosed
US-9404041-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2016-08-02 US disclosed
US-9404041-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2016-08-02 US disclosed
US-20160024386-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-01-28 US disclosed
US-20160024386-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2016-01-28 US disclosed
US-20150353829-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-12-10 US disclosed
US-20150353829-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-12-10 US disclosed