SCHEMBL9640311

SCHEMBL9640311

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.57
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
MAPK1 P28482 5/20 0.57
TDP1 Q9NUW8 4/20 0.55
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GPR35 Q9HC97 2/20 0.53
TP53 P04637 1/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 1/20 0.53
HIF1A Q16665 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
TXNRD1 Q16881 1/20 0.52
TXNRD3 Q86VQ6 1/20 0.52
TXNRD2 Q9NNW7 1/20 0.52
POLB P06746 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
Nitrogen SCHEMBL28151324 0.96 MEN1 (0.54) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL10519866 0.85 MEN1 (0.54) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL31715811 0.84 MAPT (0.73) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL9639229 0.81 MAPT (0.57) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL28748710 0.81 L3MBTL1 (0.63) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL29465849 0.81 MAPK1 (0.58) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL3132093 0.81 MAPK1 (0.58) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL16140 0.81 MAPT (0.61) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL8065650 0.81 ALDH1A1 (0.58) MAPTMEN1KMT2AMAPK1TDP1
SCHEMBL365880 0.81 MAPT (0.60) MAPTMEN1KMT2AMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103664683-B A kind of continuous diazotising production technology of aromatic amine 浙江龙盛集团股份有限公司 2018-05-11 CN claimed
CN-104725897-B A kind of ecological, environmental protective processing method of dyestuff or dyestuff intermediate 浙江龙盛集团股份有限公司 2017-08-25 CN claimed
US-5162511-A Nitrosating and diazotizing reagents and reactions GAMBLIN RODGER L (US) 1992-11-10 US claimed
EP-0387642-A2 Mixture of dyes CASSELLA Aktiengesellschaft (DE) 1990-09-19 EP claimed
CN-106118119-B Warm type disperse purple dye, its compounding mixture and preparation method thereof in resistance to highly basic 烟台澳土复合材料有限公司 2018-02-27 CN disclosed
CN-105254151-B A kind of decrement dehalogenation technique of residual active sludge 浙江清华长三角研究院 2017-09-26 CN disclosed
CN-106802296-A A kind of method for quick of the extent of reaction of Dyestuff synthesis coupling reaction 浙江闰土研究院有限公司 2017-06-06 CN disclosed
CN-103450699-B Grinding coupling method for preparing disperse dye HANGZHOU FULAIENTE FINE CHEMICAL CO LTD 2015-07-01 CN disclosed
US-5162511-A Nitrosating and diazotizing reagents and reactions GAMBLIN RODGER L (US) 1992-11-10 US disclosed
US-5136098-A Nitrosating and diazotizing reagents and reactions GAMBLIN RODGER L (US) 1992-08-04 US disclosed
US-4440681-A Water-insoluble monoazo dyestuffs and their preparation CASSELLA AKTIENGESELLSCHAFT (DE) 1984-04-03 US disclosed
EP-0039054-A1 Water-insoluble azo dyes, process for their production and their application CASSELLA Aktiengesellschaft (DE) 1981-11-04 EP disclosed
US-4210586-A COLORFAST BRIGHT BLUE SHADES ON POLYESTERS EASTMAN KODAK COMPANY (US) 1980-07-01 US disclosed
US-4181653-A Disperse dyes from 2-halo-4,6-dinitroaniline and 2(2'-alkoxy-5'-alkanoylaminoanilino)alkanes EASTMAN KODAK COMPANY (US) 1980-01-01 US disclosed