SCHEMBL7203394

SCHEMBL7203394

CCCCC(C(=O)Nc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPT P10636 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HDAC8 Q9BY41 7/20 0.48
HDAC3 O15379 5/20 0.48
HDAC6 Q9UBN7 5/20 0.48
HDAC1 Q13547 4/20 0.48
HDAC2 Q92769 4/20 0.48
HDAC4 P56524 2/20 0.48
HDAC7 Q8WUI4 2/20 0.48
HDAC10 Q969S8 2/20 0.48
HDAC11 Q96DB2 2/20 0.48
HDAC9 Q9UKV0 2/20 0.48
HDAC5 Q9UQL6 2/20 0.48
HSD17B10 Q99714 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
EPHX1 P07099 3/20 0.44

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
SCHEMBL11528868 0.94 HDAC8 (0.52) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL4440928 0.91 MAPT (0.48) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL7959730 0.81 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL5705068 0.79 MAPT (0.46) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL7099035 0.79 MEN1 (0.78) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL5524304 0.77 ALDH1A1 (0.67) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL28855894 0.77 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL5264997 0.76 MEN1 (0.61) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL11659676 0.76 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL9267426 0.76 MEN1 (0.61) ALDH1A1MEN1KMT2AMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105541740-A 5-n-butyl-1H-benzotriazole synthesis process ZHAO JIANYING 2016-05-04 CN claimed
CN-103450104-B The synthesis technique of 5-normal-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO., LTD. (CN) 2015-09-09 CN claimed
CN-103450104-A Synthesis process of 5-n-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO LTD 2013-12-18 CN claimed
CN-101245049-A Method for producing 5-n-butyl-2-benzoglioxaline methyl carbamate UNIV JIANGSU POLYTECHNIC (CN) 2008-08-20 CN claimed
CN-105541740-A 5-n-butyl-1H-benzotriazole synthesis process ZHAO JIANYING 2016-05-04 CN disclosed
CN-105541740-A 5-n-butyl-1H-benzotriazole synthesis process ZHAO JIANYING 2016-05-04 CN disclosed
CN-103450104-B The synthesis technique of 5-normal-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO., LTD. (CN) 2015-09-09 CN disclosed
CN-103450104-B The synthesis technique of 5-normal-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO., LTD. (CN) 2015-09-09 CN disclosed
CN-103450104-A Synthesis process of 5-n-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO LTD 2013-12-18 CN disclosed
CN-103450104-A Synthesis process of 5-n-butyl-1H-benzotriazole RUGAO JINLING CHEMICAL CO LTD 2013-12-18 CN disclosed
CN-101245049-A Method for producing 5-n-butyl-2-benzoglioxaline methyl carbamate UNIV JIANGSU POLYTECHNIC (CN) 2008-08-20 CN disclosed
EP-0622359-B1 Quinoxaline compound, liquid crystal composition containing the compound, liquid crystal device using the composition, display apparatus and display method CANON KK (JP) 2003-03-19 EP disclosed
US-5512209-A IMPROVED RESPONSE CHARACTERISTICS AND HIGH CONTRAST; DISPOSING COMPOSITION BETWEEN ELECTRODE PLATES CANON KABUSHIKI KAISHA (JP) 1996-04-30 US disclosed
EP-0622359-A1 Quinoxaline compound, liquid crystal composition containing the compound, liquid crystal device using the composition, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1994-11-02 EP disclosed
US-4060491-A 5-ALKYL BENZOTRIAZOLE MOBIL OIL CORPORATION (US) 1977-11-29 US disclosed