SCHEMBL3468358

SCHEMBL3468358

O=C1c2ccc(Br)cc2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 5/20 0.67
TRPV1 Q8NER1 1/20 0.67
HKDC1 Q2TB90 1/20 0.48
HPRT1 P00492 1/20 0.45
PTPRC P08575 5/20 0.44
ACHE P22303 2/20 0.43
BCHE P06276 1/20 0.43
CES1 P23141 1/20 0.43
BCL2 P10415 1/20 0.42
MCL1 Q07820 1/20 0.42
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TP53 P04637 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL6924564 0.88 PTPRC (0.58) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL14366780 0.84 HKDC1 (0.49) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL27781312 0.83 S100A4 (0.94) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL55362 0.81 S100A4 (0.62) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL159819 0.81 S100A4 (0.60) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL29413355 0.81 S100A4 (0.62) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL3207925 0.81 HKDC1 (0.55) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL74588 0.81 HKDC1 (0.65) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL29435119 0.81 HKDC1 (0.65) S100A4TRPV1HKDC1HPRT1PTPRC
SCHEMBL12604323 0.80 PTPRC (0.61) S100A4TRPV1HKDC1HPRT1PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101639635-B Electrophotographic photoreceptor and image forming apparatus SHARP KK 2012-09-05 CN disclosed
US-20100028047-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR AND IMAGE FORMING APPARATUS SHARP KABUSHIKI KAISHA (JP) 2010-02-04 US disclosed
CN-101639635-A Electrophotographic photoreceptor and image forming apparatus SHARP KK JP 2010-02-03 CN disclosed
US-20090305155-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR AND IMAGE FORMING APPARATUS PROVIDED WITH THE SAME SHARP KABUSHIKI KAISHA (JP) 2009-12-10 US disclosed
CN-101598910-A Electrophtography photosensor and have the image processing system of this Electrophtography photosensor SHARP KK (JP) 2009-12-09 CN disclosed