SCHEMBL27755136

SCHEMBL27755136

N#CCc1ccc([N+](=O)[O-])c(F)c1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
HPGD P15428 3/20 0.54
TDP1 Q9NUW8 2/20 0.36
ATM Q13315 1/20 0.36
TXNRD1 Q16881 1/20 0.34
TXNRD3 Q86VQ6 1/20 0.34
TXNRD2 Q9NNW7 1/20 0.34
VCAM1 P19320 3/20 0.32
TSHR P16473 3/20 0.32
HIF1A Q16665 2/20 0.32
GPR35 Q9HC97 1/20 0.32
RAB9A P51151 1/20 0.31
MAPT P10636 4/20 0.31
CYP3A4 P08684 2/20 0.31
POLB P06746 2/20 0.31
EGFR P00533 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL2080664 0.87 ALDH1A1 (0.57) ALDH1A1HPGDTDP1ATMVCAM1
SCHEMBL2561184 0.84 ALDH1A1 (0.54) ALDH1A1HPGDTDP1ATMVCAM1
SCHEMBL10959778 0.82 ALDH1A1 (0.70) ALDH1A1HPGDTDP1TSHRGPR35
SCHEMBL12473267 0.79 ALDH1A1 (0.47) ALDH1A1HPGDTDP1ATMVCAM1
SCHEMBL28156049 0.78 TDP1 (0.39) ALDH1A1HPGDTDP1ATMTXNRD1
SCHEMBL7291481 0.77 ALDH1A1 (0.72) ALDH1A1HPGDTDP1TSHRGPR35
SCHEMBL17919829 0.75 ALDH1A1 (0.60) ALDH1A1HPGDTDP1ATMVCAM1
SCHEMBL11901884 0.75 ALDH1A1 (0.47) ALDH1A1HPGDTDP1ATMVCAM1
SCHEMBL30681717 0.75 ALDH1A1 (0.56) ALDH1A1HPGDTDP1TSHRGPR35
SCHEMBL10958461 0.75 ALDH1A1 (0.56) ALDH1A1HPGDTDP1TSHRGPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117347542-A Quality control method of compound calcium gluconate oral solution 特丰制药有限公司 2024-01-05 CN claimed
CN-116953092-A Quality detection method for stir-fried white hyacinth bean formula particles 浙江景岳堂药业有限公司 2023-10-27 CN claimed
CN-111307990-A Method for simultaneously determining content of cystine and methionine in artificial tiger bone powder 金花企业(集团)股份有限公司西安金花制药厂 2020-06-19 CN claimed
CN-122081251-A Transformation method of L-arginine high-yield strain and application of transformation method in production 2026-05-26 CN disclosed
CN-111253298-B Separation method of L-tryptophan by ultra-high crosslinking adsorption resin 南阳师范学院 2026-05-19 CN disclosed
CN-119335071-A Trace analysis method for amino acid of hybrid protein in glucose polymer 宜昌人福药业有限责任公司 2025-01-21 CN disclosed
CN-119193571-A Co-immobilized three-enzyme system for preparing L-2-aminobutyric acid and preparation method of L-2-aminobutyric acid 河北工业大学 2024-12-27 CN disclosed
CN-117801975-A Streptococcus thermophilus with gammA-Aminobutyric acid and extracellular polysaccharide synthesis capability and application thereof 华熙生物科技股份有限公司 2024-04-02 CN disclosed
CN-117347542-A Quality control method of compound calcium gluconate oral solution 特丰制药有限公司 2024-01-05 CN disclosed
CN-117165566-A L-aspartic acid-beta-decarboxylase mutant and application thereof in preparation of L-alanine 浙江工业大学 2023-12-05 CN disclosed
CN-116953092-A Quality detection method for stir-fried white hyacinth bean formula particles 浙江景岳堂药业有限公司 2023-10-27 CN disclosed
CN-107603932-B Method for improving yield of amino acid of corynebacterium glutamicum and application of method 中国科学院微生物研究所 2020-07-21 CN disclosed
CN-111307990-A Method for simultaneously determining content of cystine and methionine in artificial tiger bone powder 金花企业(集团)股份有限公司西安金花制药厂 2020-06-19 CN disclosed
CN-110387344-A Produce the recombinant bacterium of L-Leu, the production method of its construction method and L-Leu 中国科学院微生物研究所 2019-10-29 CN disclosed
CN-106459886-B A kind of recombinant bacterium, its construction method and l-amino acid production method producing l-amino acid 中国科学院微生物研究所 2019-08-20 CN disclosed
CN-110117568-A Produce the recombinant bacterium of L-Histidine, the production method of its construction method and L-Histidine 中国科学院微生物研究所 2019-08-13 CN disclosed
CN-109810989-A The preparation method of DNA molecular, expression vector, recombinant bacterium and its construction method and hydroxyproline 中国科学院微生物研究所 2019-05-28 CN disclosed
CN-109797126-A Produce the recombinant bacterium and its construction method of Serine 中国科学院微生物研究所 2019-05-24 CN disclosed
CN-101392276-B Production of iminodiacetic acid by microorganism catalytic processes and bacterial strain thereof UNIV ZHEJIANG TECHNOLOGY 2011-05-25 CN disclosed
CN-101392276-A Production of iminodiacetic acid by microorganism catalytic processes and bacterial strain thereof UNIV ZHEJIANG TECHNOLOGY (CN) 2009-03-25 CN disclosed