SCHEMBL299878

SCHEMBL299878

NC(=O)c1cccc([N+](=O)[O-])c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.49
TSHR P16473 1/20 0.49
CTSD P07339 1/20 0.49
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
BCAT2 O15382 1/20 0.47
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CDC7 O00311 1/20 0.43
GPR35 Q9HC97 1/20 0.43
TP53 P04637 1/20 0.43
S100A4 P26447 2/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
PLAU P00749 1/20 0.42

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
SCHEMBL593074 0.87 TSHR (0.60) FBP1TSHRCTSDALDH1A1TDP1
SCHEMBL31374418 0.86 GAA (0.47) TSHRCTSDALDH1A1GPR35PARP1
SCHEMBL28202981 0.86 TSHR (0.42) FBP1TSHRCTSDALDH1A1TDP1
SCHEMBL3726481 0.84 FBP1 (0.49) FBP1TSHRCTSDALDH1A1TDP1
SCHEMBL28149001 0.83 CTSD (0.69) FBP1TSHRCTSDALDH1A1TDP1
SCHEMBL1083489 0.83 MAPT (0.47) TSHRCTSDALDH1A1CDC7GPR35
SCHEMBL27705000 0.82 KEAP1 (0.51) TSHRCTSDALDH1A1TDP1BCAT2
SCHEMBL16120026 0.82 ALDH1A1 (0.49) FBP1TSHRCTSDALDH1A1
SCHEMBL10477073 0.81 ALDH1A1 (0.53) FBP1TSHRCTSDALDH1A1TDP1
SCHEMBL10766788 0.81 CTSD (0.65) TSHRCTSDALDH1A1TDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108930-A Synthetic method and application of aminophenyl benzamide compound 合肥工业大学 2022-09-27 CN claimed
CN-103130709-B 3-aminopropionic acid piperidine amide compound with HIV activity, synthetic method and application 常州亚邦制药有限公司 2017-04-12 CN claimed
CN-103130709-B 3-aminopropionic acid piperidine amide compound with HIV activity, synthetic method and application 常州亚邦制药有限公司 2017-04-12 CN disclosed
CN-102718665-B Insecticide for agricultural or horticultural use prepare intermediate MITSUI CHEMICAL INDUSTRY CO., LTD. (JP) 2015-09-16 CN disclosed
CN-104892431-A Insecticide for agricultural or horticultural use and method of use thereof MITSUI CHEMICALS INC 2015-09-09 CN disclosed
EP-2456435-B1 HETEROARYL BENZAMIDES, COMPOSITIONS AND METHODS OF USE UNIV LELAND STANFORD JUNIOR (US) 2015-06-24 EP disclosed
CN-102976984-B Preparation intermediate of insecticide for agricultural and horticultural uses MITSUI CHEMICALS INC 2015-04-08 CN disclosed
CN-101367748-B Amide derivatives, process for production of same, and method for application thereof as insecticide MITSU CHEMICALS INC 2014-03-12 CN disclosed
CN-101684079-B Insecticide for agricultural or horticultural use and method of use thereof MITSUI CHEMICALS INC 2013-04-03 CN disclosed
CN-102976984-A Preparation intermediate of insecticide for agricultural and horticultural uses MITSUI CHEMICALS INC 2013-03-20 CN disclosed
CN-101906053-B Amide derivatives MITSU CHEMICALS INC 2012-11-21 CN disclosed
CN-101684079-A Insecticide for agricultural or horticultural use and method of use thereof MITSUI CHEMICALS INC 2010-03-31 CN disclosed
CN-100554249-C Agricultural and horticultural insecticide and method of use thereof MITSUI CHEMICALS INC (JP) 2009-10-28 CN disclosed
CN-101367748-A Amide derivatives, process for production of the same, and method for application thereof as insecticide MITSUI CHEMICALS INC (JP) 2009-02-18 CN disclosed
CN-101208009-A Composition for preventing and removing pest MITSUI CHEMICALS INC (JP) 2008-06-25 CN disclosed
CN-101203485-A Amide derivative, pesticide containing such compound and use thereof MITSUI CHEMICALS INC (JP) 2008-06-18 CN disclosed
CN-101203132-A Insecticidal and bactericidal composition MITSUI CHEMICALS INC (JP) 2008-06-18 CN disclosed
CN-101203484-A Amide derivative and pesticide containing such compound MITSUI CHEMICALS INC (JP) 2008-06-18 CN disclosed
CN-1926094-A Amide derivatives, process for their preparation and their use as pesticides MITSUI CHEMICALS INC (JP) 2007-03-07 CN disclosed
CN-1871209-A Agricultural and horticultural insecticide and method of use thereof MITSUI CHEMICALS INC (JP) 2006-11-29 CN disclosed