SCHEMBL7722672

SCHEMBL7722672

O=[N+]([O-])c1c(O)cccc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.56
ALDH1A1 P00352 6/20 0.53
TDP1 Q9NUW8 2/20 0.53
HPGD P15428 1/20 0.52
BCL2L1 Q07817 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HPRT1 P00492 1/20 0.46
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
BACE1 P56817 1/20 0.43
S100A4 P26447 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CASP6 P55212 2/20 0.42
HNF4A P41235 1/20 0.42
PSMD14 O00487 1/20 0.42
PRKACA P17612 1/20 0.42
HDAC4 P56524 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC8 Q9BY41 2/20 0.41

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
SCHEMBL29878887 1.00 GPR35 (0.56) GPR35ALDH1A1TDP1HPGDBCL2L1
SCHEMBL1767571 0.86 ALDH1A1 (0.63) GPR35ALDH1A1TDP1HPRT1CRHBP
SCHEMBL9824568 0.84 GPR35 (0.51) GPR35ALDH1A1TDP1HPGDBCL2L1
SCHEMBL11371956 0.84 GPR35 (0.51) GPR35ALDH1A1TDP1HSD17B10S100A4
SCHEMBL11385857 0.82 GPR35 (0.49) GPR35ALDH1A1
Heptanoate SCHEMBL27293248 0.81 SOAT1 (0.47) ALDH1A1TDP1HSD17B10MEN1KMT2A
SCHEMBL6396044 0.81 ALDH1A1 (0.57) ALDH1A1TDP1HSD17B10HPRT1CRHBP
SCHEMBL5707261 0.80 GPR35 (0.70) GPR35ALDH1A1TDP1HPGDS100A4
SCHEMBL5738735 0.80 HNF4A (0.58) ALDH1A1TDP1HSD17B10HPRT1MEN1
SCHEMBL29236231 0.80 ALDH1A1 (0.59) ALDH1A1TDP1HPRT1CRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109988290-A A kind of preparation method of oligomeric Metalloporphyrins and polycarbonate 中国科学院长春应用化学研究所 2019-07-09 CN claimed
CN-108997175-A The method that chlorosulfuric acid prepares m-nitrobenzene sodium sulfonate and its derivative 金华双宏化工有限公司 2018-12-14 CN claimed
CN-108774256-A A kind of preparation method of oligomeric multicenter Metalloporphyrins and makrolon 中国科学院长春应用化学研究所 2018-11-09 CN claimed
CN-108752575-A A kind of preparation method of polyester material 中国科学院长春应用化学研究所 2018-11-06 CN claimed
CN-107159147-A A kind of processing method of phenol wastewater 广东工业大学 2017-09-15 CN claimed
CN-105085275-B O-nitrophenol and its derivative synthesis method 浙江工业大学 2017-04-12 CN claimed
CN-104327036-B A kind of preparation method of cyclic carbonate 中国科学院长春应用化学研究所 2017-03-29 CN claimed
CN-106409513-A Square aluminum electrolytic capacitor based on gel electrolyte and preparation method thereof 湖南艾华集团股份有限公司 2017-02-15 CN claimed
CN-105085275-A O-nitrophenol and its derivative synthesis method UNIV ZHEJIANG TECHNOLOGY 2015-11-25 CN claimed
CN-202460166-U Distilling device for refining o-nitrophenol ANHUI HAIHUA CHEMICAL CO LTD 2012-10-03 CN claimed
CN-115124485-B Sulfoxide-containing benzoxazole derivative, and preparation method and application thereof 中国医学科学院药物研究所 2023-12-15 CN disclosed
CN-115124485-A Benzoxazole derivatives containing sulfoxide as well as preparation method and application thereof 中国医学科学院药物研究所 2022-09-30 CN disclosed
CN-108046334-B A kind of preparation method and applications of nanometer of classification hollow ball-shape iron oxide 福州大学 2019-07-12 CN disclosed
CN-109988290-A A kind of preparation method of oligomeric Metalloporphyrins and polycarbonate 中国科学院长春应用化学研究所 2019-07-09 CN disclosed
CN-109761848-A A method of preparing nitrile 四川大学 2019-05-17 CN disclosed
EP-0821982-B1 High-Temperature Desulfurization by Microorganisms JAPAN COOPERATION CT PETROLEUM (JP) 2002-05-02 EP disclosed
US-6130081-A MICROORGANISM WITH THE ABILITY TO DECOMPOSE ORGANIC SULFUR COMPOUNDS PETROLEUM ENERGY CENTER (JP) 2000-10-10 US disclosed
US-5925560-A CONTACTING ORGANIC SULFUR COMPOUNDS WITH PAENIBACILLUS; EFFICIENT CLEAVAGE OF C-S BONDS; POLLUTION CONTROL BY REMOVING SULFUR FROM PETROLEUM AND COAL PETROLEUM ENERGY CENTER (JP) 1999-07-20 US disclosed
EP-0821982-A2 High-Temperature Desulfurization by Microorganisms Petroleum Energy Center (JP) 1998-02-04 EP disclosed
US-5607857-A Rhodococcus species for removing sulfur from organic carbonaceous fuel substrates-(LAW295) EXXON RESEARCH AND ENGINEERING COMPANY (US) 1997-03-04 US disclosed