SCHEMBL6156827

SCHEMBL6156827

O=c1cc2oc3ccccc3cc-2c(-c2ccccc2[N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
LMNA P02545 2/20 0.56
MAOB P27338 2/20 0.52
GABRP O00591 1/20 0.48
GABRD O14764 1/20 0.48
GABRA1 P14867 1/20 0.48
GABRB1 P18505 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
GABRB2 P47870 1/20 0.48
GABRA4 P48169 1/20 0.48
GABRE P78334 1/20 0.48
GABRA6 Q16445 1/20 0.48
GABRG1 Q8N1C3 1/20 0.48
GABRG3 Q99928 1/20 0.48
GABRQ Q9UN88 1/20 0.48
MEN1 O00255 4/20 0.46

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
SCHEMBL8457641 0.86 ALDH1A1 (0.51) ALDH1A1LMNAMAOBGABRPGABRD
SCHEMBL9754513 0.84 ALDH1A1 (0.67) ALDH1A1LMNAMAOBGABRPGABRD
SCHEMBL18153333 0.82 MAOB (0.73) ALDH1A1LMNAMAOBMEN1KMT2A
SCHEMBL27687599 0.81 TNKS (0.52) ALDH1A1MAOBMEN1KMT2AGAA
SCHEMBL28032529 0.78 MEN1 (0.48) ALDH1A1LMNAMAOBGABRPGABRD
SCHEMBL2958058 0.78 AKR1C3 (0.52) ALDH1A1LMNAMAOBMEN1KMT2A
SCHEMBL28142645 0.77 ALDH1A1 (0.57) ALDH1A1LMNAMAOBGABRPGABRD
SCHEMBL332915 0.76 MAOB (0.63) ALDH1A1MAOBMEN1KMT2AGAA
SCHEMBL6896489 0.75 ALDH1A1 (0.48) ALDH1A1LMNAMAOBGABRPGABRD
SCHEMBL16137357 0.75 MAOB (0.52) ALDH1A1MAOBMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110498799-A A kind of fluorescence probe and its preparation method and application UNIV EAST CHINA SCIENCE & TECH 2019-11-26 CN claimed
CN-110467622-A A kind of novel kojic acid benzofuran compound and preparation method thereof CHENGDU ORGANIC CHEM CO LTD CAS 2019-11-19 CN claimed
CN-107602624-B One kind class compound of Thiadiazoline containing ferrocenyl and preparation method thereof 陕西科技大学 2019-11-19 CN claimed
CN-110437100-A Preparation method and application of novel ionic salicylaldehyde Schiff base zirconium complex UNIV SHANXI MEDICAL 2019-11-12 CN claimed
CN-106967213-B Eight-arm polyethylene glycol, preparation method, functionalized derivative and modified biologically-relevant substance 厦门赛诺邦格生物科技股份有限公司 2019-11-05 CN claimed
CN-110143886-A The method of the preparation such as beta-aromatic alkamine drug of tulobuterol, Clorprenaline, isoproterenol and Sotalol 北京化工大学 2019-08-20 CN claimed
CN-107226787-B Solvent-free preparation method of substituted cyanoacetate compound 西华大学 2019-06-14 CN claimed
CN-107017434-B Nonaqueous electrolytic solution and lithium ion secondary battery 宁德新能源科技有限公司 2019-06-11 CN claimed
CN-109678832-A One pot synthesis is synthesized the method and its product and application of Quercetin ester by rutin 郑州工业应用技术学院 2019-04-26 CN claimed
CN-109574880-A A kind of fluorescence probe and its preparation method and application 华东理工大学 2019-04-05 CN claimed
CN-103113259-A O-nitrophenyl azo salicylaldehyde phenoxy acetyl hydrazone, and synthesis and application thereof in CN<-> colorimetric detection UNIV LANZHOU JIAOTONG 2013-05-22 CN claimed
CN-103058946-A Preparation method for 2,5-disubstituted oxazole derivative UNIV ZHEJIANG TECHNOLOGY 2013-04-24 CN claimed
CN-102970867-A Aryl and heteroaryl sulfonamides as active agents against abiotic plant stress BAYER IP GMBH 2013-03-13 CN claimed
CN-102942590-A Alpha-(adamantane)amino phosphonic acid, its preparation method and application WUHAN SANJU BIOLOG TECHNOLOGY CO LTD 2013-02-27 CN claimed
CN-102875428-A Method for performing ring-opening for cyclohexylaziridine by carboxylic acid UNIV TAIYUAN TECHNOLOGY 2013-01-16 CN claimed
EP-1504257-A1 DIAGNOSTIC TEST FOR ELEMENTAL IMBALANCES Future Data Inc. (US) 2005-02-09 EP claimed
US-6821786-B2 HOME/SELF-DIAGNOSIS; MICROTRACINGS FUTURE DATA INC. 2004-11-23 US claimed
WO-2003091725-A1 DIAGNOSTIC TEST FOR ELEMENTAL IMBALANCES FUTURE DATA INC. (US) 2003-11-06 WO claimed
US-20030203495-A1 Diagnostic test for elemental imbalances FUTURE DATA INC. 2003-10-30 US claimed
CN-1362954-A Sulfamidohydroxamic acid metalloprotease inhibitor SEARLE & CO (US) 2002-08-07 CN claimed