SCHEMBL214448

SCHEMBL214448

O=C(c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.61
CES1 P23141 2/20 0.61
MAPK1 P28482 2/20 0.61
POLB P06746 1/20 0.61
ALOX5 P09917 4/20 0.60
TP53 P04637 1/20 0.59
SRD5A2 P31213 1/20 0.56
CYP3A4 P08684 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
VCAM1 P19320 1/20 0.54
ALDH1A1 P00352 3/20 0.54
TSHR P16473 2/20 0.53
ATM Q13315 2/20 0.53
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL10013242 0.96 MAPK1 (0.61) CES2CES1MAPK1POLBALOX5
Dimethylamine SCHEMBL10900525 0.93 ALOX5 (0.62) CES2CES1MAPK1POLBALOX5
SCHEMBL11829176 0.91 TP53 (0.64) CES2CES1MAPK1POLBALOX5
Benzophenone SCHEMBL27673697 0.89 CES2 (0.72) CES2CES1MAPK1POLBTP53
SCHEMBL28874927 0.88 TSHR (0.53) CES2CES1MAPK1POLBALOX5
SCHEMBL14746653 0.88 MAPK1 (0.53) CES2CES1MAPK1POLBALOX5
SCHEMBL1120804 0.88 MAPK1 (0.55) CES2CES1MAPK1POLBALOX5
SCHEMBL27523705 0.88 MAPK1 (0.53) CES2CES1MAPK1POLBALOX5
SCHEMBL1566658 0.88 CYP3A4 (0.68) CES2CES1ALOX5TP53SRD5A2
SCHEMBL333455 0.87 TP53 (0.73) CES2CES1MAPK1POLBTP53

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 172 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1752441-B1 P-TERPHENYL COMPOUND AND PHOTOSENSITIVE BODY FOR ELECTROPHOTOGRAPHY USING SUCH COMPOUND HODOGAYA CHEMICAL CO LTD (JP) 2016-12-21 EP disclosed
EP-1995234-B1 p-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME HODOGAYA CHEMICAL CO LTD (JP) 2016-01-06 EP disclosed
EP-2518046-B1 P-Terphenyl compound and electrophotographic photoconductor using the same HODOGAYA CHEMICAL CO LTD (JP) 2014-12-10 EP disclosed
EP-1818725-B1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY HODOGAYA CHEMICAL CO LTD (JP) 2014-09-10 EP disclosed
US-8808951-B2 Electrophotographic photosensitive body HODOGAYA CHEMICAL CO., LTD. (JP) 2014-08-19 US disclosed
EP-2759531-A1 P-Terphenyl compound and electrophotographic photoconductor using the same Hodogaya Chemical Co., Ltd. (JP) 2014-07-30 EP disclosed
US-8673792-B2 p-Terphenyl compound mixture and electrophotographic photoreceptors made by using the same HODOGAYA CHEMICAL CO., LTD. (JP) 2014-03-18 US disclosed
EP-1816522-B1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY HODOGAYA CHEMICAL CO LTD (JP) 2013-12-25 EP disclosed
US-20130280652-A1 P-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME HODOGAYA CHEMICAL CO LTD (JP) 2013-10-24 US disclosed
US-20130266343-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY HODOGAYA CHEMICAL CO LTD (JP) 2013-10-10 US disclosed
EP-0180931-A2 Dual layer photoreceptor for use in electrophotography MITSUBISHI KASEI CORPORATION (JP) 1986-05-14 EP disclosed
US-4560721-A HYDROGENATION DINITROBENZOPHENONE, REACTRING WITH AROMATIC DIANHYDRIDE GULF RESEARCH & DEVELOPMENT COMPANY (US) 1985-12-24 US disclosed
EP-0150707-A1 Electrophotographic photoreceptor MITSUBISHI KASEI CORPORATION (JP) 1985-08-07 EP disclosed
US-4485160-A INORGANIC PARTICLES, SENSITIZING DYES AND ELECTRON-ATTRACTING COMPOUNDS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1984-11-27 US disclosed
US-4465753-A PHOTOSENSITIVITY, DURABILITY DAINIPPON INK AND CHEMICALS INC. (JP) 1984-08-14 US disclosed
EP-0098681-A2 Novel dinitrobenzophenone solution and process for preparing an ether solution of diaminobenzophenones therefrom CHEVRON RESEARCH COMPANY (US) 1984-01-18 EP disclosed
US-4396696-A Electrophotographic plate having azo compound photosensitive layer MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1983-08-02 US disclosed
US-4367273-A Electrophotographic plate comprising a conductive substrate and a photosensitive layer containing an organic photoconductor layer composed of a hydrazone compound MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1983-01-04 US disclosed
EP-0063387-A1 Electrophotographic plate MITSUBISHI KASEI CORPORATION (JP) 1982-10-27 EP disclosed
US-4278747-A Electrophotographic plate comprising a conductive substrate and a photosensitive layer containing an organic photoconductor layer composed of a hydrazone compound MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1981-07-14 US disclosed